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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-(5-methoxy-1H-indol-3-yl)ethyl]-L-leucinamide

Catalog ID
STL542005
SMILES COc1ccc2c(c1)c(CCNC(=O)[C@@H](Nc1ccc3c(cc1=O)[C@H](CCc1c3c(OC)c(c(c1)OC)OC)NC(=O)C)CC(C)C)c[nH]2

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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 C38H46N4O7 MW 670.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H46N4O7/c1-21(2)16-32(38(45)39-15-14-24-20-40-29-12-9-25(46-4)18-27(24)29)42-31-13-10-26-28(19-33(31)44)30(41-22(3)43)11-8-23-17-34(47-5)36(48-6)37(49-7)35(23)26/h9-10,12-13,17-21,30,32,40H,8,11,14-16H2,1-7H3,(H,39,45)(H,41,43)(H,42,44)/t30-,3
InChIKey
XOTOTMRHIHQFPD-CDZUIXILSA-N
Synonyms
1574353-91-5
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(5methoxy1~(H)indol3yl)ethyl)4methylpentanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(5methoxy1Hindol3yl)ethyl)4methylpentanamide
1574353915
75491425
COc1ccc2c(c1)c(CCNC(=O)(C@@H)(Nc1ccc3c(cc1=O)(C@H)(CCc1c3c(OC)c(c(c1)OC)OC)NC(=O)C)CC(C)C)c(nH)2
InChI=1SC38H46N4O7c121(2)1632(38(45)3915142420402912925(464)1827(24)29)423113102628(1933(31)44)30(4122(3)43)118231734(475)36(486)37(497)35(23)26h91012131721303240H8111416H217H3(H3945)(H4143)(H4244)t3032m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(5methoxy1Hindol3yl)ethyl)Lleucinamide
ZINC000150653234
ZINC150653234

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Available files

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