Vitas-M small molecule compound
S-benzyl-N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]-D-cysteine
Catalog ID
STL537375
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)N[C@@H](C(=O)O)CSCc1ccccc1
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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 C28H27NO6S MW 505.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO6S/c1-16-19-11-21-18-9-5-6-10-23(18)34-25(21)13-24(19)35-28(33)20(16)12-26(30)29-22(27(31)32)15-36-14-17-7-3-2-4-8-17/h2-4,7-8,11,13,22H,5-6,9-10,12,14-15H2,1H3,(H,29,30)(H,31,32)/t22-/m1/s1InChIKey
LJCIDGIXUCJMAZ-JOCHJYFZSA-NSynonyms
(2~(S))3benzylsulfanyl2((2(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)acetyl)amino)propanoicacid
(R)3(benzylthio)2(2(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)acetamido)propanoicacid
124361502
InChI=1SC28H27NO6Sc116191121189561023(18)3425(21)1324(19)3528(33)20(16)1226(30)2922(27(31)32)153614177324817h2478111322H56910121415H21H3(H2930)(H3132)t22m1s1
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)N(C@H)(C(=O)O)CSCc1ccccc1
SbenzylN((4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)acetyl)Dcysteine
ZINC000016032436
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