Vitas-M small molecule compound
{(2'R,2''R,5''R,6''S,8a''S)-2'',5'',8a''-trimethyl-5-oxo-6''-[(phenylcarbonyl)oxy]decahydro-2''H-dispiro[furan-3,4'-furan-2',1''-naphthalen]-5''-yl}methyl benzoate
Catalog ID
STL525434
SMILES O=C1OCC2(C1)CO[C@]1(C2)[C@H](C)CCC2[C@]1(C)CC[C@@H]([C@@]2(C)COC(=O)c1ccccc1)OC(=O)c1ccccc1
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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 C34H40O7 MW 560.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40O7/c1-23-14-15-26-31(2,20-39-29(36)24-10-6-4-7-11-24)27(41-30(37)25-12-8-5-9-13-25)16-17-32(26,3)34(23)19-33(22-40-34)18-28(35)38-21-33/h4-13,23,26-27H,14-22H2,1-3H3/t23-,26?,27+,31+,32+,33?,34-/m1/s1InChIKey
BBMGIIRPEGLULA-STDVVWHOSA-NSynonyms
956960-92-2((2R2R5R6S8aS)258atrimethyl5oxo6((phenylcarbonyl)oxy)decahydro2Hdispiro(furan34furan21naphthalen)5yl)methylbenzoate
(1R2R5R6S8aS)5((benzoyloxy)methyl)258atrimethyl5oxooctahydro2Hdispiro(naphthalene1243bis(oxolane))6ylbenzoate
16395748
2((5HYDROXYPYRIDINE3CARBONYL)AMINO)BUTANEDIOICACID
2((5HYDROXYPYRIDINE3CARBONYL)AMINO)SUCCINICACID
956960922
InChI=1SC10H10N2O6c13615(31146)9(16)127(10(17)18)28(14)15h134713H2H2(H1216)(H1415)(H1718)
MFCD01546230
O=C1OCC2(C1)CO(C@)1(C2)(C@H)(C)CCC2(C@)1(C)CC(C@@H)((C@@)2(C)COC(=O)c1ccccc1)OC(=O)c1ccccc1
ZINC000070665469
ZINC000070665475
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