Vitas-M small molecule compound
S-methyl-N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-D-cysteine
Catalog ID
STL463443
SMILES CSC[C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
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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 C23H25NO6S MW 443.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO6S/c1-12-13(7-8-21(25)24-17(11-31-2)22(26)27)23(28)30-19-10-20-16(9-15(12)19)14-5-3-4-6-18(14)29-20/h9-10,17H,3-8,11H2,1-2H3,(H,24,25)(H,26,27)/t17-/m1/s1InChIKey
KDMARFWNPXDZSG-QGZVFWFLSA-NSynonyms
(2S)2(3(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)3methylsulfanylpropanoicacid
(R)2(3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)3(methylthio)propanoicacid
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2)CCC(=O)NC(CSC)C(=O)O
CSC(C@@H)(C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
CSC(C@H)(C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
InChI=1SC23H25NO6Sc11213(7821(25)2417(11312)22(26)27)23(28)3019102016(915(12)19)14534618(14)2920h91017H3811H212H3(H2425)(H2627)t17m1s1
MFCD06495980
SmethylN(3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)Dcysteine
ZINC000011865409
ZINC11865409
Check stock
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Check stock on Vitas-MAvailable files
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