Vitas-M small molecule compound
S-benzyl-N-[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-cysteine
Catalog ID
STL537843
SMILES O=C(N[C@@H](C(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C
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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 C26H25NO6S MW 479.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO6S/c1-15-12-32-22-11-23-20(10-19(15)22)16(2)18(26(31)33-23)8-9-24(28)27-21(25(29)30)14-34-13-17-6-4-3-5-7-17/h3-7,10-12,21H,8-9,13-14H2,1-2H3,(H,27,28)(H,29,30)/t21-/m1/s1InChIKey
PIQYHRSIPFECTR-OAQYLSRUSA-NSynonyms
(2~(S))3benzylsulfanyl2(3(35dimethyl7oxofuro(32g)chromen6yl)propanoylamino)propanoicacid
(R)3(benzylthio)2(3(35dimethyl7oxo7Hfuro(32g)chromen6yl)propanamido)propanoicacid
124385509
InChI=1SC26H25NO6Sc115123222112320(1019(15)22)16(2)18(26(31)3323)8924(28)2721(25(29)30)143413176435717h37101221H891314H212H3(H2728)(H2930)t21m1s1
O=C(N(C@H)(C(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C
SbenzylN(3(35dimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)Dcysteine
ZINC000026771848
ZINC26771848
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