Vitas-M small molecule compound
(2R)-phenyl{[(4,8,8-trimethyl-2-oxo-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl)acetyl]amino}ethanoic acid
Catalog ID
STL540801
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C)N[C@H](c1ccccc1)C(=O)O
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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 C25H25NO6 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO6/c1-14-17-11-16-9-10-25(2,3)32-19(16)13-20(17)31-24(30)18(14)12-21(27)26-22(23(28)29)15-7-5-4-6-8-15/h4-8,11,13,22H,9-10,12H2,1-3H3,(H,26,27)(H,28,29)/t22-/m1/s1InChIKey
QIIKFMIAUASZHX-JOCHJYFZSA-NSynonyms
956971-55-4(2~(R))2phenyl2((2(226trimethyl8oxo34dihydropyrano(32g)chromen7yl)acetyl)amino)aceticacid
(2R)phenyl(((488trimethyl2oxo78dihydro2H6Hpyrano(32g)chromen3yl)acetyl)amino)ethanoicacid
(R)2phenyl2(2(488trimethyl2oxo2678tetrahydropyrano(32g)chromen3yl)acetamido)aceticacid
16408397
956971554
InChI=1SC25H25NO6c11417111691025(23)3219(16)1320(17)3124(30)18(14)1221(27)2622(23(28)29)157546815h48111322H91012H213H3(H2627)(H2829)t22m1s1
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C)N(C@H)(c1ccccc1)C(=O)O
ZINC000012896336
ZINC12896336
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