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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-(furan-2-yl)ethyl]-L-isoleucinamide

Catalog ID
STL540473
SMILES CC[C@H]([C@@H](C(=O)NCCc1ccco1)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C33H41N3O7 MW 591.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H41N3O7/c1-7-19(2)30(33(39)34-15-14-22-9-8-16-43-22)36-26-13-11-23-24(18-27(26)38)25(35-20(3)37)12-10-21-17-28(40-4)31(41-5)32(42-6)29(21)23/h8-9,11,13,16-19,25,30H,7,10,12,14-15H2,1-6H3,(H,34,39)(H,35,37)(H,36,38)/t19-,25+,30+/m1/s1
InChIKey
RCOWHZDEIPBJAR-PFTPNIEWSA-N
Synonyms
1574337-84-0
(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(furan2yl)ethyl)3methylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(furan2yl)ethyl)3methylpentanamide
1574337840
75491179
CC(C@H)((C@@H)(C(=O)NCCc1ccco1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC33H41N3O7c1719(2)30(33(39)3415142298164322)362613112324(1827(26)38)25(3520(3)37)1210211728(404)31(415)32(426)29(21)23h89111316192530H710121415H216H3(H3439)(H3537)(H3638)t1925+30+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(furan2yl)ethyl)Lisoleucinamide
ZINC000108447922
ZINC108447922

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Available files

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