Vitas-M small molecule compound
(3R,3aS,5aS,9bS)-5a,9-dimethyl-3-((3,3,5-trimethylazepan-1-yl)methyl)-3a,4,5,5a-tetrahydronaphtho[1,2-b]furan-2,8(3H,9bH)-dione
Catalog ID
STL548213
SMILES CC1CCN(CC(C1)(C)C)CC1C(=O)O[C@H]2[C@H]1CC[C@@]1(C2=C(C)C(=O)C=C1)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 C24H35NO3 MW 385.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H35NO3/c1-15-8-11-25(14-23(3,4)12-15)13-18-17-6-9-24(5)10-7-19(26)16(2)20(24)21(17)28-22(18)27/h7,10,15,17-18,21H,6,8-9,11-14H2,1-5H3/t15?,17-,18?,21-,24-/m0/s1InChIKey
ZKHQMBPYBVPJKV-NRPMQWRGSA-NSynonyms
956932-65-3(3~(a)~(S)5~(a)~(S)9~(b)~(S))5~(a)9dimethyl3((335trimethylazepan1yl)methyl)3~(a)459~(b)tetrahydro3~(H)benzo(g)(1)benzofuran28dione
(3AS5AS9BS)5A9DIMETHYL3(335TRIMETHYLAZEPAN1YLMETHYL)3A55A9BTETRAHYDRO3H4HNAPHTHO(12B)FURAN28DIONE
(3R3aS5aS9bS)5a9dimethyl3((335trimethylazepan1yl)methyl)3a455atetrahydronaphtho(12b)furan28(3H9bH)dione
16396372
956932653
CC1CCN(CC(C1)(C)C)CC1C(=O)O(C@H)2(C@H)1CC(C@@)1(C2=C(C)C(=O)C=C1)C
InChI=1SC24H35NO3c11581125(1423(34)1215)1318176924(5)10719(26)16(2)20(24)21(17)2822(18)27h71015171821H6891114H215H3t15?1718?2124m0s1
ZINC000004027260
ZINC000012658145
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