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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(1H-indol-3-yl)ethyl]-L-methioninamide

Catalog ID
STL541644
SMILES CSCC[C@@H](C(=O)NCCc1c[nH]c2c1cccc2)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)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 C36H42N4O6S MW 658.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H42N4O6S/c1-21(41)39-28-12-10-22-18-32(44-2)34(45-3)35(46-4)33(22)25-11-13-29(31(42)19-26(25)28)40-30(15-17-47-5)36(43)37-16-14-23-20-38-27-9-7-6-8-24(23)27/h6-9,11,13,18-20,28,30,38H,10,12,14-17H2,1-5H3,(H,37,43)(H,39,41)(H,40,42)/t28-,30-/m0
InChIKey
ALUCGDNYVOJDCK-JDXGNMNLSA-N
Synonyms
1574291-96-5
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(1~(H)indol3yl)ethyl)4methylsulfanylbutanamide
(S)N(2(1Hindol3yl)ethyl)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)butanamide
1574291965
75491991
CSCC(C@@H)(C(=O)NCCc1c(nH)c2c1cccc2)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC36H42N4O6Sc121(41)39281210221832(442)34(453)35(464)33(22)25111329(31(42)1926(25)28)4030(1517475)36(43)37161423203827976824(23)27h6911131820283038H10121417H215H3(H3743)(H3941)(H4042)t2830m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(1Hindol3yl)ethyl)Lmethioninamide
ZINC000150653586
ZINC150653586

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Available files

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