Vitas-M small molecule compound
(2'R,3S,3aR,8aR,9aR)-3-(((2-methoxyphenethyl)amino)methyl)-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL562836
SMILES COc1ccccc1CCNCC1C(=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 C24H33NO4 MW 399.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33NO4/c1-23-9-5-10-24(15-28-24)21(23)12-17-18(22(26)29-20(17)13-23)14-25-11-8-16-6-3-4-7-19(16)27-2/h3-4,6-7,17-18,20-21,25H,5,8-15H2,1-2H3/t17-,18?,20-,21?,23-,24+/m1/s1InChIKey
LKIBGRZTZMJKEF-PFJLNHIPSA-NSynonyms
956913-03-4(2R3S3aR8aR9aR)3(((2methoxyphenethyl)amino)methyl)8amethyldecahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3aR5R8aR9aR)3((2(2methoxyphenyl)ethylamino)methyl)8amethylspiro(3a44a67899aoctahydro3Hbenzo(f)(1)benzofuran52oxirane)2one
16398894
956913034
COc1ccccc1CCNCC1C(=O)O(C@H)2(C@@H)1CC1(C@)(C2)(C)CCC(C@)21OC2
InChI=1SC24H33NO4c123951024(152824)21(23)121718(22(26)2920(17)1323)142511816634719(16)272h34671718202125H5815H212H3t1718?2021?2324+m1s1
ZINC000004046226
ZINC000012661907
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