Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-(((4-methoxyphenethyl)amino)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one
Catalog ID
STL528013
SMILES COc1ccc(cc1)CCNCC1C(=O)O[C@H]2[C@@H]1CC1C(=C)CCC[C@@]1(C2)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 C24H33NO3 MW 383.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33NO3/c1-16-5-4-11-24(2)14-22-19(13-21(16)24)20(23(26)28-22)15-25-12-10-17-6-8-18(27-3)9-7-17/h6-9,19-22,25H,1,4-5,10-15H2,2-3H3/t19-,20?,21?,22-,24-/m1/s1InChIKey
FJUTWCVPMLKPLN-BQLVCVCHSA-NSynonyms
956957-86-1(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((2(4methoxyphenyl)ethylamino)methyl)8~(a)methyl5methylidene3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3(((4methoxyphenethyl)amino)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)one
16398329
956957861
COc1ccc(cc1)CCNCC1C(=O)O(C@H)2(C@@H)1CC1C(=C)CCC(C@@)1(C2)C
InChI=1SC24H33NO3c116541124(2)142219(1321(16)24)20(23(26)2822)15251210176818(273)9717h69192225H1451015H223H3t1920?21?2224m1s1
ZINC000004043834
ZINC000012661645
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