Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-(((2-(diethylamino)ethyl)amino)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one oxalate
Catalog ID
STL533780
SMILES CCN(CCNCC1C(=O)O[C@H]2[C@@H]1CC1C(=C)CCC[C@@]1(C2)C)CC
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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 C21H36N2O2 MW 348.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H36N2O2/c1-5-23(6-2)11-10-22-14-17-16-12-18-15(3)8-7-9-21(18,4)13-19(16)25-20(17)24/h16-19,22H,3,5-14H2,1-2,4H3/t16-,17?,18?,19-,21-/m1/s1InChIKey
OZLBETOWSCJFKV-UCMFBROFSA-NSynonyms
(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((2(diethylamino)ethylamino)methyl)8~(a)methyl5methylidene3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3(((2(diethylamino)ethyl)amino)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)oneoxalate
16404069
InChI=1SC21H36N2O2c1523(62)111022141716121815(3)87921(184)1319(16)2520(17)24h161922H3514H2124H3t1617?18?1921m1s1
OC(=O)C(=O)OCCN(CCNCC1C(=O)O(C@H)2(C@@H)1CC1C(=C)CCC(C@@)1(C2)C)CC
ZINC000020612049
ZINC000022920501
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