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Compound Structure IUPAC Name: (2R)-N-[(3S,6S,8S,12S,13R,16S,17R,20S,23S)-13-[(2S)-butan-2-yl]-12-hydroxy-20-[(4-methoxyphenyl)methyl]-6,17,21-trimethyl-3-(2-methylpropyl)-2,5,7,10,15,19,22-heptaoxo-8-propan-2-yl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosan-16-yl]-4-methyl-2-(methylamino)pentanamide | CAS Registry Number: 77327-04-9
Synonyms: didemnins, Didemnin A, Oncoprecipitin A, Didemnin D, Didemnin E, CHEBI:623530, AIDS121097, NSC 325319, NSC 351910, AIDS-121097, CID123844, LS-186759, LS-187439, (3S-(1(2R*,4R*),3R*,4S*,5R*))-N-(1-(N-(4-((3-Hydroxy-5-methyl-4-((N-(N-methyl-D-leucyl)-L-threonyl)amino)-1-oxoheptyl)oxy)-2,5-dimethyl-1,3-dioxohexyl)-L-leucyl)-L-prolyl)-N,O-dimethyl-L-tyrosine phi-lactone, L-Tyrosine, N-(1-(N-(4-((3-hydroxy-5-methyl-4-((N-(N-methyl-D-leucyl)-L-threonyl)amino)-1-oxoheptyl)oxy)-2,5-dimethyl-1,3-dioxohexyl)-L-leucyl)-L-prolyl)-N,O-dimethyl-, phi-lactone, (3S-((2R*,4R*),3R*,4S*,5R*))-, 15H-Pyrrolo(2,1-f)(1,15,4,7,10,20)dioxatetraazacyclotricosine, cyclic peptide deriv, 15H-Pyrrolo(2,1-f)(1,15,4,7,10,20)dioxatetraazacyclotricosine, cyclic peptide deriv.

Molecular Formula: C49H78N6O12Molecular Weight: 943.176620 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 13

InChIKey: XQZOGOCTPKFYKC-VSZULPIASA-N

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