CAS Number
Molecular Formula
C57H89N7O15
Product format
Neat
Molecular Weight
1112.37
API Family
Synonyms
Didemnin B; 77327-05-0; OR65D8FK1B; NSC-325319; (2S)-N-[(2R)-1-[[(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]amino]-4-methyl-1-oxopentan-2-yl]-1-[(2S)-2-hydroxypropanoyl]-N-methylpyrrolidine-2-carboxamide; Didemnin A, N-(1-(2-hydroxy-1-oxopropyl)-L-prolyl)-, (S)-; DTXSID80228068; NSC-333841; NSC325319; NSC333841; (2S)-N-((2R)-1-(((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)amino)-4-methyl-1-oxopentan-2-yl)-1-((2S)-2-hydroxypropanoyl)-N-methylpyrrolidine-2-carboxamide; RefChem:586920; CHEBI:90209; DTXCID00150559; 15H-Pyrrolol(2, 1-f)(1, 15, 4, 7, 10, 20)dioxatetraazacyclotri-cosine, Cyclic Peptide Deriv.; (1R)-N-((2R)-1-(((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)amino)-4-methyl-1-oxopentan-2-yl)-2-((2S)-2-hydroxypropanoyl)-N-methylcyclopentane-1-carboxamide; (2S)-N-((2R)-1-(((3S, 6S, 8R, 12S, 13R, 16S, 17R, 20S, 23S)-20-benzyl-13-((2S)-butan-2-yl)-12-hydroxy-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)amino)-4-methyl-1-oxopentan-2-yl)-1-((2S)-2-hydroxypropanoyl)-N-methylpyrrolidine-2-carboxamide; L-Tyrosine, N-(1-(N-(4-((3-Hydroxy-4-((N-(N-(1-(2-hydroxy-1-oxopropyl)-L-prolyl)-N-methyl-L-leucyl)-L-threonyl)amino)-5-methyl-1-oxoheptyl)oxy)-2, 5-dimethyl-1, 3-dioxohexyl)-L-leucyl)-L-prolyl)-N, O-dimethyl-, phi-lactone; N-((2R)-1-(((3S, 6S, 8S, 12S, 13R, 16S, 17R, 20S)-13-((2S)-butan-2-yl)-20-((4-methoxyphenyl)methyl)-6, 12, 17, 21-tetramethyl-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)amino)-4-methyl-1-oxopentan-2-yl)-1-(2-hydroxypropanoyl)-N-methylpyrrolidine-2-carboxamide; N-((2R)-1-(((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 and 21-tetrazabicyclo(21.3.0)hexacosan-16-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-(2-hydroxypropanoyl)-N-methylpyrrolidine-2-carboxamide
Iupac Name
(2S)-N-[(2R)-1-[[(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 and 21-tetrazabicyclo[21.3.0]hexacosan-16-yl]amino]-4-methyl-1-oxopentan-2-yl]-1-[(2S)-2-hydroxypropanoyl]-N-methylpyrrolidine-2-carboxamide
InChI
InChI=1S/C57H89N7O15/c1-15-33(8)46-44(66)29-45(67)79-49(32(6)7)48(68)34(9)50(69)58-39(26-30(2)3)54(73)64-25-17-19-41(64)56(75)62(13)43(28-37-20-22-38(77-14)23-21-37)57(76)78-36(11)47(52(71)59-46)60-51(70)42(27-31(4)5)61(12)55(74)40-18-16-24-63(40)53(72)35(10)65/h20-23,30-36,39-44,46-47,49,65-66H,15-19,24-29H2,1-14H3,(H,58,69)(H,59,71)(H,60,70)/t33-,34-,35-,36+,39-,40-,41-,42+,43-,44-,46+,47-,49-/m0/s1
