Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-((3,3-dimethylpiperidin-1-yl)methyl)-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL548645
SMILES O=C1O[C@H]2[C@@H](C1CN1CCCC(C1)(C)C)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 C22H35NO3 MW 361.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H35NO3/c1-20(2)6-5-9-23(13-20)12-16-15-10-18-21(3,11-17(15)26-19(16)24)7-4-8-22(18)14-25-22/h15-18H,4-14H2,1-3H3/t15-,16?,17-,18?,21-,22?/m1/s1InChIKey
FNZNQMPYMHYTSI-YLSYZSGGSA-NSynonyms
(2R3S3aR8aR9aR)3((33dimethylpiperidin1yl)methyl)8amethyldecahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((33dimethylpiperidin1yl)methyl)8~(a)methylspiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
135639793
InChI=1SC22H35NO3c120(2)65923(1320)121615101821(31117(15)2619(16)24)74822(18)142522h1518H414H213H3t1516?1718?2122?m1s1
O=C1O(C@H)2(C@@H)(C1CN1CCCC(C1)(C)C)CC1(C@)(C2)(C)CCC(C@)21OC2
ZINC000012659932
ZINC001772492811
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