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6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[1-(3-methylbutyl)-1H-indol-5-yl]hexanamide

Catalog ID
STL548000
SMILES COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)Nc1ccc2c(c1)ccn2CCC(C)C)NC(=O)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 C40H50N4O6 MW 682.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H50N4O6/c1-25(2)17-20-44-21-18-27-22-29(12-16-34(27)44)43-37(47)10-8-7-9-19-41-33-15-13-30-31(24-35(33)46)32(42-26(3)45)14-11-28-23-36(48-4)39(49-5)40(50-6)38(28)30/h12-13,15-16,18,21-25,32H,7-11,14,17,19-20H2,1-6H3,(H,41,46)(H,42,45)(H,43,47)
InChIKey
NFIKVQOCKBLZLZ-YTTGMZPUSA-N
Synonyms

(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1isopentyl1Hindol5yl)hexanamide
125429806
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1(3methylbutyl)indol5yl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1(3methylbutyl)1Hindol5yl)hexanamide
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)Nc1ccc2c(c1)ccn2CCC(C)C)NC(=O)C
InChI=1SC40H50N4O6c125(2)1720442118272229(121634(27)44)4337(47)1087919413315133031(2435(33)46)32(4226(3)45)1411282336(484)39(495)40(506)38(28)30h1213151618212532H71114171920H216H3(H4146)(H4245)(H4347)t32m0s1
ZINC000524731193
ZINC524731193

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Available files

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