Vitas-M small molecule compound
(1aR,1bR,4R,4aS,7R,7aS,9aR)-4-((2,6-dimethylmorpholino)methyl)-7,9a-dimethyloctahydro-1aH-oxireno[2',3':7,8]naphtho[8a,1-b]furan-3(4H)-one
Catalog ID
STL547378
SMILES CC1OC(C)CN(C1)CC1C(=O)O[C@@]23[C@H]1CC[C@H]([C@@H]2CC[C@@]1([C@H]3O1)C)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 C21H33NO4 MW 363.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H33NO4/c1-12-5-6-17-15(11-22-9-13(2)24-14(3)10-22)18(23)25-21(17)16(12)7-8-20(4)19(21)26-20/h12-17,19H,5-11H2,1-4H3/t12-,13?,14?,15?,16+,17+,19-,20-,21-/m1/s1InChIKey
RUZUDZSTUUEQRC-CQADDZFUSA-NSynonyms
1212436-91-3(1~(R)5~(S)8~(R)9~(S)12~(R)14~(R))4((26dimethylmorpholin4yl)methyl)812dimethyl213dioxatetracyclo(7500^(15)0^(1214))tetradecan3one
(1aR1bR4R4aS7R7aS9aR)4((26dimethylmorpholino)methyl)79adimethyloctahydro1aHoxireno(2378)naphtho(8a1b)furan3(4H)one
1212436913
16399875
CC1OC(C)CN(C1)CC1C(=O)O(C@@)23(C@H)1CC(C@H)((C@@H)2CC(C@@)1((C@H)3O1)C)C
InChI=1SC21H33NO4c112561715(1122913(2)2414(3)1022)18(23)2521(17)16(12)7820(4)19(21)2620h121719H511H214H3t1213?14?15?16+17+192021m1s1
MFCD32650041
ZINC000020412366
ZINC000020412374
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