Vitas-M small molecule compound
(2'R,3S,3aR,8aR,9aR)-8a-methyl-3-((2-methylpiperidin-1-yl)methyl)decahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL526290
SMILES CC1CCCCN1CC1C(=O)O[C@H]2[C@@H]1CC1[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 C21H33NO3 MW 347.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H33NO3/c1-14-6-3-4-9-22(14)12-16-15-10-18-20(2,11-17(15)25-19(16)23)7-5-8-21(18)13-24-21/h14-18H,3-13H2,1-2H3/t14?,15-,16?,17-,18?,20-,21+/m1/s1InChIKey
IHANHCGTYJEQAK-LBCKPXHZSA-NSynonyms
1212438-15-7(2R3S3aR8aR9aR)8amethyl3((2methylpiperidin1yl)methyl)decahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3~(a)~(R)5~(R)8~(a)~(R)9~(a)~(R))8~(a)methyl3((2methylpiperidin1yl)methyl)spiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
1212438157
16396973
CC1CCCCN1CC1C(=O)O(C@H)2(C@@H)1CC1(C@)(C2)(C)CCC(C@)21OC2
InChI=1SC21H33NO3c114634922(14)121615101820(21117(15)2519(16)23)75821(18)132421h1418H313H212H3t14?1516?1718?2021+m1s1
ZINC000004028475
ZINC000252694290
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