Vitas-M small molecule compound
(2'R,3S,3aR,4aR,8aR,9aR)-3-((4-benzhydrylpiperazin-1-yl)methyl)-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL540401
SMILES O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)C(c1ccccc1)c1ccccc1)C[C@@H]1[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 C32H40N2O3 MW 500.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N2O3/c1-31-13-8-14-32(22-36-32)28(31)19-25-26(30(35)37-27(25)20-31)21-33-15-17-34(18-16-33)29(23-9-4-2-5-10-23)24-11-6-3-7-12-24/h2-7,9-12,25-29H,8,13-22H2,1H3/t25-,26?,27-,28-,31-,32+/m1/s1InChIKey
NDMZHFFFMUFVCW-MEEGSPKRSA-NSynonyms
956970-71-1(2R3S3aR4aR8aR9aR)3((4benzhydrylpiperazin1yl)methyl)8amethyldecahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3~(a)~(R)4~(a)~(R)5~(R)8~(a)~(R)9~(a)~(R))3((4benzhydrylpiperazin1yl)methyl)8~(a)methylspiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
16401503
956970711
InChI=1SC32H40N2O3c1311381432(223632)28(31)192526(30(35)3727(25)2031)2133151734(181633)29(2394251023)24116371224h279122529H81322H21H3t2526?27283132+m1s1
O=C1O(C@H)2(C@@H)(C1CN1CCN(CC1)C(c1ccccc1)c1ccccc1)C(C@@H)1(C@)(C2)(C)CCC(C@)21OC2
ZINC000085902231
ZINC000085902232
Check stock
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