Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-((dibenzylamino)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one
Catalog ID
STL566092
SMILES O=C1O[C@H]2[C@@H](C1CN(Cc1ccccc1)Cc1ccccc1)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 C29H35NO2 MW 429.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO2/c1-21-10-9-15-29(2)17-27-24(16-26(21)29)25(28(31)32-27)20-30(18-22-11-5-3-6-12-22)19-23-13-7-4-8-14-23/h3-8,11-14,24-27H,1,9-10,15-20H2,2H3/t24-,25?,26?,27-,29-/m1/s1InChIKey
HSBSDJNJPQPKOI-QOHLEXOSSA-NSynonyms
312963-18-1(3aR8aR9aR)3((dibenzylamino)methyl)8amethyl5methylidene3a44a67899aoctahydro3Hbenzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3((dibenzylamino)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)one
16395102
312963181
InChI=1SC29H35NO2c1211091529(2)172724(1626(21)29)25(28(31)3227)2030(1822115361222)1923137481423h3811142427H19101520H22H3t2425?26?2729m1s1
O=C1O(C@H)2(C@@H)(C1CN(Cc1ccccc1)Cc1ccccc1)CC1(C@)(C2)(C)CCCC1=C
ZINC000004023271
ZINC000012652864
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