PRODUCT NAME | CAS Registry Number |
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(5 suppliers)
Synonyms: Macrospegatrine, CID6443913, CID 6443913, 18-Normacralstonidinium, 1,1',4-tridemethyl-4',21-dimethyl-17-methylene-, (4'alpha,15beta,16beta,21beta)-
Molecular Formula: | C40H45N4O3+ | Molecular Weight: | 629.810300 [g/mol] | H-Bond Donor: | 4 | H-Bond Acceptor: | 4 |
InChIKey: PYPRVISVQWHLLM-DENHBWNVSA-N
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(6 suppliers)
IUPAC Name: (4S,9R,10S,15R,16S)-9,15-dihydroxy-4,10,16-trimethyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione | CAS Registry Number: 172923-77-2
Synonyms: Macrosphelide A, CTK8F0249
Molecular Formula: | C16H22O8 | Molecular Weight: | 342.341080 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 8 |
InChIKey: MJMMUATWVTYSFD-JZRPKSSGSA-N
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(8 suppliers)
IUPAC Name: 1,7-dihydroxy-3-methoxy-6-methylanthracene-9,10-dione | CAS Registry Number: 22225-67-8
Synonyms: Macrosporin, CHEBI:564606, CID159926, 1,7-Dihydroxy-3-methoxy-6-methyl-9,10-anthracenedione, 9,10-Anthracenedione, 1,7-dihydroxy-3-methoxy-6-methyl-
Molecular Formula: | C16H12O5 | Molecular Weight: | 284.263480 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 5 |
InChIKey: FKTPLNFTYJEAAB-UHFFFAOYSA-N
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(5 suppliers)
Synonyms: Macrostemonoside A, CID197480, beta-D-Galactopyranoside, (3-beta,5alpha,25R)-spirostan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-, Tigogenin-3-O-beta-D-glucopyranosyl(1-2)(beta-D-glucopyranosyl(1-3))-beta-D-glucopyranosyl(1-4)-beta-D-galactopyranoside
Molecular Formula: | C51H84O23 | Molecular Weight: | 1065.198860 [g/mol] | H-Bond Donor: | 14 | H-Bond Acceptor: | 23 |
InChIKey: JWWCJQFYNBGCAX-UOUUDHCBSA-N
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(5 suppliers)
Synonyms: Macrostemonoside D, CID197481, CID 197481, beta-D-Galactopyranoside, (3beta,5alpha,25R)-spirostan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-6-O-acetyl-beta-D-glucopyranosyl-(1-4)-, Tigogenin 3-O-beta-D-glucopyranosyl(1-2)(beta-D-glucopyranosyl(1-3)(6-O-acetyl-beta-D-glucopyranosyl))(1-4)-beta-D-galactopyranoside
Molecular Formula: | C53H86O24 | Molecular Weight: | 1107.235540 [g/mol] | H-Bond Donor: | 13 | H-Bond Acceptor: | 24 |
InChIKey: DYIQIQXTTUXBQD-DZYXBILISA-N
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(5 suppliers)
Synonyms: Macrostemonoside E, CID3083447, CID 3083447, 26-O-Glucopyranosyl-5-furost-20(22)-ene-3,26-diol-3-O-glucopyranosyl-1-2-(glucopranosyl-1-3)-glucopyranosyl-1-4-galactopyranoside, beta-D-Galactopyranoside, (3beta,5alpha,25R)-26-(beta-D-glucopyranosyloxy)furost-20(22)-en-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-
Molecular Formula: | C57H94O28 | Molecular Weight: | 1227.339460 [g/mol] | H-Bond Donor: | 18 | H-Bond Acceptor: | 28 |
InChIKey: VSBKPYBNYCDOSW-JGMLVQILSA-N
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(5 suppliers)
Synonyms: Anemarsaponin B, Macrostemonoside F, CID192523, 26-O-Glucopyranosyl-5alpha-furost-20(22)-ene-3,26-diol-3-O-glucopyranosyl-1-2-galactoside, beta-D-Galactopyranoside, (3beta,5beta,25R)-26-(beta-D-glucopyranosyloxy)furost-20(22)-en-3-yl 2-O-beta-D-glucopyranosyl-
Molecular Formula: | C45H74O18 | Molecular Weight: | 903.058260 [g/mol] | H-Bond Donor: | 11 | H-Bond Acceptor: | 18 |
InChIKey: ROHLIYKWVMBBFX-SBLTYFQLSA-N
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(3 suppliers)
IUPAC Name: 2-fluoro-N-(4-methylphenyl)-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylbenzamide | CAS Registry Number: 6801-17-8
Synonyms: Oprea1_116219, MolPort-007-927-697, CID5215439, 2-fluoro-N-(4-methylphenyl)-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-benzamide
Molecular Formula: | C23H23FN4O3S | Molecular Weight: | 454.517123 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 7 |
InChIKey: UKQOAUSXTAGHJA-UHFFFAOYSA-N
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(1 supplier)
IUPAC Name: methyl (1S,12S,13S,14S,15E,17R)-15-ethylidene-13-(hydroxymethyl)-17-methyl-3-aza-17-azoniapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate;chloride | CAS Registry Number: 2697-31-6
Synonyms: UNII-58992VKD0P, 58992VKD0P, Macusine C, chloride, Akuammidine methochloride, 16-Epimacusine A chloride, Macusine C chloride [MI], Sarpaganium, 17-hydroxy-16-(methoxycarbonyl)-4-methyl-, chloride, Sarpaganium, 17-hydroxy-16-(methoxycarbonyl)-4-methyl-, chloride (1:1), Q27261576
Molecular Formula: | C22H27ClN2O3 | Molecular Weight: | 402.900 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 4 |
InChIKey: XZCJRBLVMDQZHO-CEXPNPHSSA-M
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(7 suppliers)
IUPAC Name: 5-[[4-[bis(2-methylpropyl)amino]-3-nitrophenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione | CAS Registry Number: 312271-03-7
Synonyms: M2I-1, MLS000572003, SMR000194022, 5-[4-(diisobutylamino)-3-nitrobenzylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione, 5-[[4-[bis(2-methylpropyl)amino]-3-nitrophenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 6063-97-4, AC1METFS, MLS003905101, CHEMBL1571889, BDBM48705, cid_2883762, DTXSID00387207, MolPort-002-182-435, HMS2507P14, ZINC4180848, STK753645, AKOS001706294, CS-5670, MCULE-8543479456, HY-100341
Molecular Formula: | C19H24N4O4S | Molecular Weight: | 404.485 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 6 |
InChIKey: BWEKPQUKWLNUKX-UHFFFAOYSA-N
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(2 suppliers)
IUPAC Name: 1,3,8-trihydroxy-6-methyl-2-(1,6,8-trihydroxy-3-methyl-9,10-dioxoanthracen-2-yl)anthracene-9,10-dione | CAS Registry Number: 36506-89-5
Molecular Formula: | C30H18O10 | Molecular Weight: | 538.457920 [g/mol] | H-Bond Donor: | 6 | H-Bond Acceptor: | 10 |
InChIKey: DKDXVSSXDBKLAU-UHFFFAOYSA-N
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(6 suppliers)
IUPAC Name: 2-[2-[(dimethylamino)methyl]phenyl]sulfanyl-5-methylaniline;dihydrochloride | CAS Registry Number: 411208-45-2
Synonyms: MADAM dihydrochloride, AGN-PC-00SMA8, SureCN1230664, M8193_SIGMA, CTK8E8394, 2-(2'-Amino-4'-methylphenylthio)-N,N-dimethylbenzylamine dihydrochloride, 2-[2-[(dimethylamino)methyl]phenyl]sulfanyl-5-methylaniline;dihydrochloride, 2-(2 inverted exclamation marka-Amino-4 inverted exclamation marka-methylphenylthio)-N,N-dimethylbenzylamine dihydrochloride
Molecular Formula: | C16H22Cl2N2S | Molecular Weight: | 345.330280 [g/mol] | H-Bond Donor: | 3 | H-Bond Acceptor: | 3 |
InChIKey: GSBZMNLLLNHKDY-UHFFFAOYSA-N
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(2 suppliers)
IUPAC Name: 2-[2-[(dimethylamino)methyl]phenyl]sulfanyl-5-methylaniline;dihydrochloride | CAS Registry Number: 1049740-95-5
Synonyms: 411208-45-2, SCHEMBL1230664, CTK8E8394, DTXSID50582028, 2-({2-[(Dimethylamino)methyl]phenyl}sulfanyl)-5-methylaniline--hydrogen chloride (1/2)
Molecular Formula: | C16H22Cl2N2S | Molecular Weight: | 345.300 [g/mol] | H-Bond Donor: | 3 | H-Bond Acceptor: | 3 |
InChIKey: GSBZMNLLLNHKDY-UHFFFAOYSA-N
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(1 supplier)
IUPAC Name: N-methyl-1-(6-methyl-1,3-benzodioxol-5-yl)propan-2-amine | CAS Registry Number: 207740-46-3
Synonyms: SureCN5480610
Molecular Formula: | C12H17NO2 | Molecular Weight: | 207.268880 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 3 |
InChIKey: CRQPDNIUPWXPNK-UHFFFAOYSA-N
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(4 suppliers)
IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,8R,8aR,10R,11R,12aR,14bS)-8,10,11-trihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | CAS Registry Number: 26532-66-1
Synonyms: Madasiatic acid, SCHEMBL5797165
Molecular Formula: | C30H48O5 | Molecular Weight: | 488.709 [g/mol] | H-Bond Donor: | 4 | H-Bond Acceptor: | 5 |
InChIKey: WRACWYWAPQQRKC-QZSWZRGBSA-N
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(28 suppliers)
IUPAC Name: 8,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | CAS Registry Number: 18449-41-7
Synonyms: Brahmic acid, Madecassic acid, NSC88135, CID258809, NCI60_041951, 2,3,6,23-tetrahydroxyurs-12-en-28-oic acid
Molecular Formula: | C30H48O6 | Molecular Weight: | 504.698520 [g/mol] | H-Bond Donor: | 5 | H-Bond Acceptor: | 6 |
InChIKey: PRAUVHZJPXOEIF-UHFFFAOYSA-N
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(33 suppliers)
IUPAC Name: [6-[[3,4-dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 8,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate | CAS Registry Number: 34540-22-2
Synonyms: EINECS 252-076-1, CID161823, O-6-Deoxy-alpha-L-mannopyranosyl-(1.4)-O-beta-D-glucopyranosyl-(1.6)-beta-D-glucopyranosyl (2alpha,3beta,4alpha,6beta)-2,3,6,23-tetrahydroxyurs-12-en-28-oate
Molecular Formula: | C48H78O20 | Molecular Weight: | 975.120920 [g/mol] | H-Bond Donor: | 13 | H-Bond Acceptor: | 20 |
InChIKey: BNMGUJRJUUDLHW-UHFFFAOYSA-N
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(3 suppliers)
IUPAC Name: 1-hydroxy-4-methoxy-2-methylanthracene-9,10-dione | CAS Registry Number: 36532-00-0
Synonyms: Madeirin
Molecular Formula: | C16H12O4 | Molecular Weight: | 268.268 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 4 |
InChIKey: ZCYWBTZIWLDHTK-UHFFFAOYSA-N
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(2 suppliers)
IUPAC Name: 1-(1-hydroxy-5,7,8-trimethoxy-3,4-dioxonaphthalen-2-yl)propan-2-yl acetate | CAS Registry Number: 98941-58-3
Molecular Formula: | C18H20O8 | Molecular Weight: | 364.346600 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 8 |
InChIKey: BBMJALGKCLSLAE-UHFFFAOYSA-N
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(1 supplier)
IUPAC Name: (2S)-2-[[(3aS,8bR)-8b-hydroxy-2,3a-dihydro-1H-furo[2,3-b]indol-4-yl]methyl]-4-butyl-2,5-dimethylcyclopent-4-ene-1,3-dione | CAS Registry Number: 184877-65-4
Synonyms: (+)-Madindoline B
Molecular Formula: | C22H27NO4 | Molecular Weight: | 369.500 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 5 |
InChIKey: XPVQXXLKOCZMGG-FDFHNCONSA-N
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(1 supplier)
IUPAC Name: (2S)-2-[[(3aS,8bR)-8b-hydroxy-2,3a-dihydro-1H-furo[2,3-b]indol-4-yl]methyl]-4-butyl-2,5-dimethylcyclopent-4-ene-1,3-dione | CAS Registry Number: 184877-65-4
Synonyms: (+)-Madindoline B
Molecular Formula: | C22H27NO4 | Molecular Weight: | 369.500 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 5 |
InChIKey: XPVQXXLKOCZMGG-FDFHNCONSA-N
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(6 suppliers)
IUPAC Name: (5S,8R,9S,10S,13S,14S,17S)-10,13,17-trimethyl-1,4,5,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol | CAS Registry Number: 3275-64-7
Synonyms: Ba 2665, NSC 63329, Sc 11977, CID18651, NSC63329, 17-Methyl-5-alpha-androst-2-en-17-beta-ol, LS-19469, C15101, 5-alpha-ANDROST-2-EN-17-beta-OL, 17-METHYL-, Androst-2-en-17-ol, 17-methyl-, (5-alpha,17-beta)-, 17-alpha-Methyl-(5-alpha)-delta(sup 2)-androstene-17-beta-ol
Molecular Formula: | C20H32O | Molecular Weight: | 288.467480 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 1 |
InChIKey: FRVHJVATKMIOPQ-PAPWGAKMSA-N
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(1 supplier)
IUPAC Name: (1aR,3aS,7aS,7bR)-1,1,3a-trimethyl-2,3,5,6,7a,7b-hexahydro-1aH-cyclopropa[a]naphthalene-4,7-dione | CAS Registry Number: 217481-21-5
Synonyms: UNII-89NNG49F98, 89NNG49F98, Madolin F, (+)-Madolin F, 1H-Cyclopropa(a)naphthalene-4,7-dione, octahydro-1,1,3a-trimethyl-, (1aR,3aS,7aS,7bR)-
Molecular Formula: | C14H20O2 | Molecular Weight: | 220.307400 [g/mol] | H-Bond Donor: | 0 | H-Bond Acceptor: | 2 |
InChIKey: FKOKHQSDRFQWNI-PKINLEFWSA-N
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(4 suppliers)
IUPAC Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid; 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide | CAS Registry Number: 37270-69-2
Synonyms: madopar, Modopar, Madopa, benserazide - levodopa, Ro 8-0576, Benserazide combination with Levodopa, Ro 8-0576-7, Ro 8-0576-12, CID123809, benserazide, levodopa drug combination, LS-158308, C005177, L-Tyrosine, 3-hydroxy-, mixt. with DL-serine 2-((2,3,4-trihydroxyphenyl)methyl)hydrazide
Molecular Formula: | C19H26N4O9 | Molecular Weight: | 454.431140 [g/mol] | H-Bond Donor: | 11 | H-Bond Acceptor: | 12 |
InChIKey: QFLMOYQNYBDXMT-ZCMDIHMWSA-N
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(8 suppliers)
IUPAC Name: 2-[(7-methoxy-4-methylquinazolin-2-yl)amino]-5,6-dimethyl-1H-pyrimidin-4-one | CAS Registry Number: 374913-63-0
Synonyms: SMR000135614, MLS000530636, STK565742, 2-[(7-methoxy-4-methyl-2-quinazolinyl)amino]-5,6-dimethyl-4(1H)-pyrimidinone, 2-[(7-methoxy-4-methylquinazolin-2-yl)amino]-5,6-dimethyl-1H-pyrimidin-4-one, AC1LG6XH, Oprea1_005944, Oprea1_681074, cid_816255, Madrasin, >=98% (HPLC), CHEMBL1523019, STOCK2S-03737, BDBM67840, CHEBI:114316, MolPort-000-711-786, MolPort-001-849-069, MolPort-004-412-946, HMS2406F03, ZINC8838164, CCG-18454
Molecular Formula: | C16H17N5O2 | Molecular Weight: | 311.345 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 4 |
InChIKey: QQJIYKXTEMDJFM-UHFFFAOYSA-N
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IUPAC Name: (5S,6E,8E,13E,15S,16R,19S)-5-hydroxy-7,15,19-trimethyl-16-propan-2-yl-17,24-dioxa-11,20,25-triazabicyclo[20.2.1]pentacosa-1(25),6,8,13,22-pentaene-3,12,18,21-tetrone | CAS Registry Number: 58678-44-7
Synonyms: BRN 1097168, LS-88557
Molecular Formula: | C26H35N3O7 | Molecular Weight: | 501.572000 [g/mol] | H-Bond Donor: | 3 | H-Bond Acceptor: | 8 |
InChIKey: VQNWNKSWWORSDJ-YHOGAPGHSA-N
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