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4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)butanamide

Catalog ID
STL549395
SMILES COc1cc2CCC(c2cc1OC)NC(=O)CCCNc1ccc2c(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 C36H43N3O8 MW 645.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H43N3O8/c1-20(40)38-27-13-10-22-17-32(45-4)35(46-5)36(47-6)34(22)23-11-14-28(29(41)18-25(23)27)37-15-7-8-33(42)39-26-12-9-21-16-30(43-2)31(44-3)19-24(21)26/h11,14,16-19,26-27H,7-10,12-13,15H2,1-6H3,(H,37,41)(H,38,40)(H,39,42)/t26?,27-/m0/s1
InChIKey
KHVVXZRVODRJID-GEVKEYJPSA-N
Synonyms

127253505
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(56dimethoxy23dihydro1~(H)inden1yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(56dimethoxy23dihydro1Hinden1yl)butanamide
4(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(56dimethoxy23dihydro1Hinden1yl)butanamide
COc1cc2CCC(c2cc1OC)NC(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC36H43N3O8c120(40)38271310221732(454)35(465)36(476)34(22)23111428(29(41)1825(23)27)37157833(42)3926129211630(432)31(443)1924(21)26h111416192627H710121315H216H3(H3741)(H3840)(H3942)t26?27m0s1
ZINC000604404162
ZINC000604404163

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Available files

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