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N-[(7S)-1,2,3-trimethoxy-10-{[(2S)-4-methyl-1-oxo-1-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)pentan-2-yl]amino}-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide

Catalog ID
STL547660
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)N[C@H](C(=O)N1CCc2c(C1)[nH]c1c2cccc1)CC(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C38H44N4O6 MW 652.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H44N4O6/c1-21(2)17-31(38(45)42-16-15-25-24-9-7-8-10-28(24)40-32(25)20-42)41-30-14-12-26-27(19-33(30)44)29(39-22(3)43)13-11-23-18-34(46-4)36(47-5)37(48-6)35(23)26/h7-10,12,14,18-19,21,29,31,40H,11,13,15-17,20H2,1-6H3,(H,39,43)(H,41,44)/t29-,31-
InChIKey
LQBYTFPUFDHSSJ-SMCANUKXSA-N
Synonyms

~(N)((7~(S))123trimethoxy10(((2~(S))4methyl1oxo1(1349tetrahydropyrido(34b)indol2yl)pentan2yl)amino)9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
121541958
COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1(C@H)(CC2)NC(=O)C)N(C@H)(C(=O)N1CCc2c(C1)(nH)c1c2cccc1)CC(C)C
InChI=1SC38H44N4O6c121(2)1731(38(45)42161525249781028(24)4032(25)2042)413014122627(1933(30)44)29(3922(3)43)1311231834(464)36(475)37(486)35(23)26h7101214181921293140H1113151720H216H3(H3943)(H4144)t2931m0s1
N((7S)123trimethoxy10(((2S)4methyl1oxo1(1349tetrahydro2Hbetacarbolin2yl)pentan2yl)amino)9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
N((S)10(((S)1(34dihydro1Hpyrido(34b)indol2(9H)yl)4methyl1oxopentan2yl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000263585723
ZINC263585723

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Available files

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