Vitas-M small molecule compound
N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]valine
Catalog ID
STL511796
SMILES O=C(NC(C(=O)O)C(C)C)CCc1c(=O)oc2c(c1C)cc1c(c2C)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 C25H29NO6 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO6/c1-12(2)21(24(28)29)26-20(27)10-9-15-13(3)17-11-18-16-7-5-6-8-19(16)31-23(18)14(4)22(17)32-25(15)30/h11-12,21H,5-10H2,1-4H3,(H,26,27)(H,28,29)InChIKey
YGXCMYUXDJCCBR-UHFFFAOYSA-NSynonyms
(S)2(3(411dimethyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)3methylbutanoicacid
2(3(411dimethyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)3methylbutanoicacid
3752313
InChI=1SC25H29NO6c112(2)21(24(28)29)2620(27)1091513(3)17111816756819(16)3123(18)14(4)22(17)3225(15)30h111221H510H214H3(H2627)(H2829)
MFCD31751823
N(3(411dimethyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)valine
O=C(N(C@H)(C(=O)O)C(C)C)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2
ZINC000002107413
ZINC000015953740
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