Vitas-M small molecule compound
(1aR,2S,5aR,6aR,9S,9aR,9bS)-9-((benzyl(methyl)amino)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Catalog ID
STL533770
SMILES CN(CC1C(=O)O[C@H]2[C@@H]1[C@@H]1O[C@@]31[C@](C2)(C)CCC[C@@H]3C)Cc1ccccc1
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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 C23H31NO3 MW 369.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31NO3/c1-15-8-7-11-22(2)12-18-19(20-23(15,22)27-20)17(21(25)26-18)14-24(3)13-16-9-5-4-6-10-16/h4-6,9-10,15,17-20H,7-8,11-14H2,1-3H3/t15-,17?,18+,19+,20-,22+,23-/m0/s1InChIKey
GUEMLDIJFWCIGQ-VRWJMIDKSA-NSynonyms
956817-43-9(1~(R)3~(S)4~(R)8~(R)10~(R)14~(S))5((benzyl(methyl)amino)methyl)1014dimethyl27dioxatetracyclo(8400^(13)0^(48))tetradecan6one
(1aR2S5aR6aR9S9aR9bS)9((benzyl(methyl)amino)methyl)25adimethyloctahydro2Hoxireno(2344a)naphtho(23b)furan8(9bH)one
16403733
956817439
CN(CC1C(=O)O(C@H)2(C@@H)1(C@@H)1O(C@@)31(C@)(C2)(C)CCC(C@@H)3C)Cc1ccccc1
InChI=1SC23H31NO3c115871122(2)121819(2023(1522)2720)17(21(25)2618)1424(3)131695461016h46910151720H781114H213H3t1517?18+19+2022+23m0s1
MFCD32649955
ZINC000004084428
ZINC000012881370
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