Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-cyclohexyl-L-isoleucinamide
Catalog ID
STL541656
SMILES CC[C@H]([C@@H](C(=O)NC1CCCCC1)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 C33H45N3O6 MW 579.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H45N3O6/c1-7-19(2)30(33(39)35-22-11-9-8-10-12-22)36-26-16-14-23-24(18-27(26)38)25(34-20(3)37)15-13-21-17-28(40-4)31(41-5)32(42-6)29(21)23/h14,16-19,22,25,30H,7-13,15H2,1-6H3,(H,34,37)(H,35,39)(H,36,38)/t19-,25+,30+/m1/s1InChIKey
SIQLAZYCFVQWNV-PFTPNIEWSA-NSynonyms
1574379-07-9(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)cyclohexyl3methylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Ncyclohexyl3methylpentanamide
1574379079
75492579
CC(C@H)((C@@H)(C(=O)NC1CCCCC1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC33H45N3O6c1719(2)30(33(39)35221198101222)362616142324(1827(26)38)25(3420(3)37)1513211728(404)31(415)32(426)29(21)23h141619222530H71315H216H3(H3437)(H3539)(H3638)t1925+30+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)NcyclohexylLisoleucinamide
ZINC000108451550
ZINC108451550
Check stock
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Check stock on Vitas-MAvailable files
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