Vitas-M small molecule compound
1,8-dihydroxy-11a,13a-dimethyl-2,3,3a,3b,4,5,5a,6,11,11a,11b,12,13,13a-tetradecahydro-1H-cyclopenta[5,6]naphtho[1,2-g]quinoline-9,10-dicarbonitrile
Catalog ID
STL528274
SMILES N#Cc1c2CC3(C)C(Cc2nc(c1C#N)O)CCC1C3CCC2(C1CCC2O)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 C24H29N3O2 MW 391.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2/c1-23-8-7-19-14(18(23)5-6-21(23)28)4-3-13-9-20-15(10-24(13,19)2)16(11-25)17(12-26)22(29)27-20/h13-14,18-19,21,28H,3-10H2,1-2H3,(H,27,29)InChIKey
RONRYQJFHZPPMI-UHFFFAOYSA-NSynonyms
18dihydroxy11a13adimethyl233a3b455a61111a11b121313atetradecahydro1Hcyclopenta(56)naphtho(12g)quinoline910dicarbonitrile
3760242
6hydroxy15dimethyl17oxo16azapentacyclo(11800^(210)0^(59)0^(1520))henicosa15(20)18diene1819dicarbonitrile
InChI=1SC24H29N3O2c123871914(18(23)5621(23)28)431392015(1024(1319)2)16(1125)17(1226)22(29)2720h131418192128H310H212H3(H2729)
MFCD03805746
ZINC000012661528
ZINC000252441347
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