Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-((4-benzhydrylpiperazin-1-yl)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one
Catalog ID
STL527521
SMILES O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)C(c1ccccc1)c1ccccc1)CC1[C@](C2)(C)CCCC1=C
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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 C32H40N2O2 MW 484.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N2O2/c1-23-10-9-15-32(2)21-29-26(20-28(23)32)27(31(35)36-29)22-33-16-18-34(19-17-33)30(24-11-5-3-6-12-24)25-13-7-4-8-14-25/h3-8,11-14,26-30H,1,9-10,15-22H2,2H3/t26-,27?,28?,29-,32-/m1/s1InChIKey
VZJTZHOUQBRIEP-URGFVHFPSA-NSynonyms
956925-16-9(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((4benzhydrylpiperazin1yl)methyl)8~(a)methyl5methylidene3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3((4benzhydrylpiperazin1yl)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)one
16397975
956925169
InChI=1SC32H40N2O2c1231091532(2)212926(2028(23)32)27(31(35)3629)2233161834(191733)30(24115361224)25137481425h3811142630H19101522H22H3t2627?28?2932m1s1
O=C1O(C@H)2(C@@H)(C1CN1CCN(CC1)C(c1ccccc1)c1ccccc1)CC1(C@)(C2)(C)CCCC1=C
ZINC000020113774
ZINC000020113783
Check stock
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