Vitas-M small molecule compound
(2'R,3S,3aR,8aR,9aR)-3-((4-(hydroxydiphenylmethyl)piperazin-1-yl)methyl)-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL528047
SMILES O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)C(c1ccccc1)(c1ccccc1)O)CC1[C@](C2)(C)CCC[C@]21OC2
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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 C32H40N2O4 MW 516.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N2O4/c1-30-13-8-14-31(22-37-31)28(30)19-25-26(29(35)38-27(25)20-30)21-33-15-17-34(18-16-33)32(36,23-9-4-2-5-10-23)24-11-6-3-7-12-24/h2-7,9-12,25-28,36H,8,13-22H2,1H3/t25-,26?,27-,28?,30-,31+/m1/s1InChIKey
OTDIQTBCQZWOSR-RZIQIXPNSA-NSynonyms
956993-91-2(2R3S3aR8aR9aR)3((4(hydroxydiphenylmethyl)piperazin1yl)methyl)8amethyldecahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3~(a)~(R)5~(R)8~(a)~(R)9~(a)~(R))3((4(hydroxy(diphenyl)methyl)piperazin1yl)methyl)8~(a)methylspiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
16398699
956993912
InChI=1SC32H40N2O4c1301381431(223731)28(30)192526(29(35)3827(25)2030)2133151734(181633)32(362394251023)24116371224h27912252836H81322H21H3t2526?2728?3031+m1s1
O=C1O(C@H)2(C@@H)(C1CN1CCN(CC1)C(c1ccccc1)(c1ccccc1)O)CC1(C@)(C2)(C)CCC(C@)21OC2
ZINC000020410924
ZINC000020410933
Check stock
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