PRODUCT NAME | CAS Registry Number |
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IUPAC Name: (4R,5R,8R,9E)-9-ethylidene-5,8-dihydroxy-4-propyl-5,7,8,10-tetrahydro-4H-cyclonona[c]furan-1,3,6-trione | CAS Registry Number: 123068-35-9
Synonyms: Cornexistin, CID6439145, LS-57686, 1H-Cyclonona(c)furan-1,3,6-trione, 4,5,7,8,9,10-hexahydro-5,8-dihydroxy-9-ethylidene-4-propyl-, (4R*,5R*,8R*)-, 1H-Cyclonona(c)furan-1,3,6-trione, 9-ethylidene-4,5,7,8,9,10-hexahydro-5,8-dihydroxy-4-propyl-, (4R*,5R*,8R*)-
Molecular Formula: | C16H20O6 | Molecular Weight: | 308.326400 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 6 |
InChIKey: ILMHTGUGRLGMCR-UJCPQBBRSA-N
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Synonyms: Cornigerine, NSC358825, NSC 358825, CID100188, LS-10242, Acetamide, N-(4,6,7,8-tetrahydro-3,13-dimethoxy-4-oxoheptaleno(1,2-f)(1,3)benzodioxol-6-yl)-, (S)-, Acetamide, N-(4,6,7,8-tetrahydro-3,13-dimethoxy-4-oxoheptaleno[1,2-f][1,3]benzodioxol-6-yl)-, (S)-, Acetamide, N-(4,6,7,8-tetrahydro-3,13-dimethyoxy-4-oxoheptaleno[1,2-f][1,3]benzodioxol-6-yl)-, (S)-
Molecular Formula: | C21H21NO6 | Molecular Weight: | 383.394540 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 6 |
InChIKey: DCYAJVOKJAFSES-UHFFFAOYSA-N
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(1 supplier)
IUPAC Name: methyl (7S)-7-methyl-5-oxo-6,7-dihydrocyclopenta[c]pyridine-4-carboxylate | CAS Registry Number: 173043-58-8
Synonyms: Corninine
Molecular Formula: | C11H11NO3 | Molecular Weight: | 205.213 [g/mol] | H-Bond Donor: | 0 | H-Bond Acceptor: | 4 |
InChIKey: QXATZAIEBLGEJK-LURJTMIESA-N
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IUPAC Name: 4-hydroxy-4-[2-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]cyclohexa-2,5-dien-1-one | CAS Registry Number: 40661-45-8
Synonyms: AC1MJ39M, 4-hydroxy-4-[2-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]cyclohexa-2,5-dien-1-one
Molecular Formula: | C14H20O8 | Molecular Weight: | 316.303800 [g/mol] | H-Bond Donor: | 5 | H-Bond Acceptor: | 8 |
InChIKey: VTVARPTUBCBNJX-WJTVCTBASA-N
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IUPAC Name: methyl (2R,3S,4R)-3-ethenyl-4-[2-(3,4,5-trihydroxybenzoyl)oxyethyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | CAS Registry Number: 131189-57-6
Synonyms: CID131348, CID 131348, 2H-Pyran-5-carboxylic acid, 3-ethenyl-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-4-(2-((3,4,5-trihydroxybenzoyl)oxy)ethyl)-, methyl ester, (2S-(2alpha,3beta,4beta))-
Molecular Formula: | C24H30O14 | Molecular Weight: | 542.486600 [g/mol] | H-Bond Donor: | 7 | H-Bond Acceptor: | 14 |
InChIKey: SMTKSCGLXONVGL-ZEIULZLQSA-N
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(3 suppliers)
Synonyms: Cornusiin A, AIDS081136, AIDS-081136, D-Glucose, cyclic 4-2':6-2-(4-(6-carboxy-2,3,4-trihydroxyphenoxy)-4',5,5',6,6'-pentahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 2,3-bis(3,4,5-trihydroxybenzoate), 2-ester with D-glucose cyclic 4,6-(4,4',5',5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 3-(3,4,5-trihydroxybenzoate), stereoisomer, D-Glucose, cyclic 4.fwdarw.2':6.fwdarw.2-[(1S)-4-(6-carboxy-2,3,4-trihydroxyphenoxy)-4',5,5',6,6'-pentahydroxy[1,1'-biphenyl]-2,2'-dicarboxylate] 2,3-bis(3,4,5-trihydroxybenzoate), 2-ester with D-glucose cyclic 4,6-[(1S)-4,4',5,5',6,6'-hexahydroxy[1,1'-biphenyl]-2,2'-dicarboxylate] 3-(3,4,5-trihydroxybenzoate)
Molecular Formula: | C68H50O44 | Molecular Weight: | 1571.098200 [g/mol] | H-Bond Donor: | 25 | H-Bond Acceptor: | 44 |
InChIKey: CGTQPVKZNROYFH-UHFFFAOYSA-N
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(3 suppliers)
Synonyms: Cornusiin B, D-Glucose, cyclic 4,6-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 2-(2-((5,10-dihydro-3,7,8-trihydroxy-5,10-dioxo(1)benzopyrano(5,4,3-cde)-(1)benzopyran-2-yl)oxy)-3,4,5-trihydroxybenzoate) 3-(3,4,5-trihydroxybenzoate), stereoisomer
Molecular Formula: | C48H30O30 | Molecular Weight: | 1086.733800 [g/mol] | H-Bond Donor: | 16 | H-Bond Acceptor: | 30 |
InChIKey: IBUZLJOVINHPCM-UHFFFAOYSA-N
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(4 suppliers)
Synonyms: Cornusiin C, D-Glucose, cyclic 4-2':6-2-(4-(6-carboxy-2,3,4-trihydroxyphenoxy)-4',5,5',6,6'-pentahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate)-3-(3,4,5-trihydroxybenzoate), 2-ester with D-glucose cyclic 4-2':(4-(6-carboxy-2,3,4-trihydroxyphenoxy)-4',5,5',6,6'-pentahydroxy(1,1'-biphenyl)-2,2'-dicarboylate) 2,3-bis(3,4,5-trihydroxybenzoate), 2'-ester with D-glucose cyclic 4,6-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 3-(3,4,5-trihydroxybenzoate), stereoisomer
Molecular Formula: | C102H74O65 | Molecular Weight: | 2339.639960 [g/mol] | H-Bond Donor: | 36 | H-Bond Acceptor: | 65 |
InChIKey: DKWBPKQHAPBPBK-IIJAWXDASA-N
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IUPAC Name: [(2R,3R,4S,5R,6S)-3,6-dihydroxy-4,5-bis(3-nitropropanoyloxy)oxan-2-yl]methyl 3-nitropropanoate | CAS Registry Number: 63461-31-4
Synonyms: AC1L4BI5, [(2R,3R,4S,5R,6S)-3,6-dihydroxy-4,5-bis(3-nitropropanoyloxy)oxan-2-yl]methyl 3-nitropropanoate
Molecular Formula: | C15H21N3O15 | Molecular Weight: | 483.338340 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 15 |
InChIKey: XQHIJIKPDBEMSE-WMNSZERYSA-N
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(2 suppliers)
IUPAC Name: [(8S)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoate | CAS Registry Number: 85798-06-7
Synonyms: Coromandalinine
Molecular Formula: | C15H25NO4 | Molecular Weight: | 283.368 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 5 |
InChIKey: DRVWTOSBCBKXOR-OSAQELSMSA-N
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(2 suppliers)
IUPAC Name: (E)-3-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]prop-2-enoic acid | CAS Registry Number: 1145689-64-0
Synonyms: (11E)-14,15,16-Trinorlabda-8(20),11-dien-13-oic acid
Molecular Formula: | C17H26O2 | Molecular Weight: | 262.393 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 2 |
InChIKey: GZRHZZSARAUGHK-VIJNKSRKSA-N
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IUPAC Name: (3aS,6R,7aS)-6-ethyl-1-oxo-2,3,3a,6,7,7a-hexahydroindene-4-carboxylic acid | CAS Registry Number: 62251-98-3
Synonyms: Coronafacic acid, CID114969, C15765, 6-Ethyl-2,3,3aS,6R,7,7aS-hexahydro-1-oxo-1H-indene-4-Carboxylic acid, 1H-Indene-4-Carboxylic acid, 6-ethyl-2,3,3a,6,7,7a-hexahydro-1-oxo-, (3aS,6R,7aS)-, 1H-Indene-4-Carboxylic acid, 6-ethyl-2,3,3a,6,7,7a-hexahydro-1-oxo-, (3aS-(3alpha,6beta,7aalpha))-
Molecular Formula: | C12H16O3 | Molecular Weight: | 208.253640 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 3 |
InChIKey: ONMAUQRMJXNSCG-VGMNWLOBSA-N
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Molecular Formula: | C30H46O4 | Molecular Weight: | 470.694 [g/mol] | H-Bond Donor: | 2 | H-Bond Acceptor: | 4 |
InChIKey: IOFXIXOKOAYADV-DUQIGAQYSA-N
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(8 suppliers)
Molecular Formula: | C30H42O5 | Molecular Weight: | 482.661 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 5 |
InChIKey: YLQIANWVVVMWMO-VNGDBYLQSA-N
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(9 suppliers)
Molecular Formula: | C31H44O5 | Molecular Weight: | 496.688 [g/mol] | H-Bond Donor: | 0 | H-Bond Acceptor: | 5 |
InChIKey: FPFAZZFTBDKRJL-HGMCFIIDSA-N
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Synonyms: Coronardine, (-)-Coronaridine, Indole alkaloid derivative, Methyl ibogamine-18-carboxylate, CHEBI:407402, AIDS014839, AIDS-014839, CID73489, 4503-12-2 (mono-hydrochloride), EINECS 207-398-7, NSC127490, NSC 127490, Ibogamine-18-carboxylic acid, methyl ester, C09139, methyl (1S,15S,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.0^{2,10}.0^{4,9}.0^{13,18}]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
Molecular Formula: | C21H26N2O2 | Molecular Weight: | 338.443340 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 3 |
InChIKey: NVVDQMVGALBDGE-KSWFMABOSA-N
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(1 supplier)
Synonyms: methyl 19-hydroxyibogamine-18-carboxylate hydrochloride (1:1)
Molecular Formula: | C21H27ClN2O3 | Molecular Weight: | 390.903680 [g/mol] | H-Bond Donor: | 3 | H-Bond Acceptor: | 4 |
InChIKey: AJIYIDKEZBBKQG-UHFFFAOYSA-N
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(11 suppliers)
IUPAC Name: (2S,4R,4aS,8aS)-4-[(E)-2-(furan-3-yl)ethenyl]-4a,8,8-trimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-ol | CAS Registry Number: 119188-33-9
Synonyms: CHEMBL64407, MolPort-035-705-812, ZINC26163116, W1344
Molecular Formula: | C20H28O2 | Molecular Weight: | 300.442 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 2 |
InChIKey: RHCBUXSXDFNUAG-UDMCIFMYSA-N
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(11 suppliers)
IUPAC Name: 7-[(1R,4aR,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-hydroxy-4,7-dihydro-3H-dioxepine-5-carbaldehyde | CAS Registry Number: 119188-38-4
Molecular Formula: | C20H30O4 | Molecular Weight: | 334.456 [g/mol] | H-Bond Donor: | 1 | H-Bond Acceptor: | 4 |
InChIKey: FTQNGEYQJGYGFY-PVSAOXIISA-N
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