Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-8a-methyl-3-((4-phenylpiperazin-1-yl)methyl)decahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL532361
SMILES O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)c1ccccc1)CC1[C@](C2)(C)CCCC21OC2
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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 C25H34N2O3 MW 410.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N2O3/c1-24-8-5-9-25(17-29-25)22(24)14-19-20(23(28)30-21(19)15-24)16-26-10-12-27(13-11-26)18-6-3-2-4-7-18/h2-4,6-7,19-22H,5,8-17H2,1H3/t19-,20?,21-,22?,24-,25?/m1/s1InChIKey
HZXWBBKUNZOOBZ-CJRXOLPQSA-NSynonyms
1212494-46-6(3~(a)~(R)8~(a)~(R)9~(a)~(R))8~(a)methyl3((4phenylpiperazin1yl)methyl)spiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
(3S3aR8aR9aR)8amethyl3((4phenylpiperazin1yl)methyl)decahydro2Hspiro(naphtho(23b)furan52oxiran)2one
1212494466
16405020
InChI=1SC25H34N2O3c12485925(172925)22(24)141920(23(28)3021(19)1524)1626101227(131126)186324718h24671922H5817H21H3t1920?2122?2425?m1s1
ZINC000059415316
ZINC000082051588
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