Vitas-M small molecule compound
17-hydroxy-10,13-dimethyl-1,2,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolane]-17-carbonitrile
Catalog ID
STL146312
SMILES N#CC1(O)CCC2C1(C)CCC1C2CC=C2C1(C)CCC1(C2)OCCO1
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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 C22H31NO3 MW 357.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31NO3/c1-19-9-10-22(25-11-12-26-22)13-15(19)3-4-16-17(19)5-7-20(2)18(16)6-8-21(20,24)14-23/h3,16-18,24H,4-13H2,1-2H3InChIKey
VRSHJJXUDZAQKD-UHFFFAOYSA-NSynonyms
33261-95-9(10R13S17S)17hydroxy1013dimethyl1247891011121314151617tetradecahydrospiro(cyclopenta(a)phenanthrene32(13)dioxolane)17carbonitrile
17hydroxy1013dimethyl1247891011121314151617tetradecahydrospiro(cyclopenta(a)phenanthrene32(13)dioxolane)17carbonitrile
17hydroxy1013dimethylspiro(13dioxolane23247891112141516decahydro1Hcyclopenta(a)phenanthrene)17carbonitrile
33261959
CC12CCC3(CC1=CCC4C2CCC5(C4CCC5(C#N)O)C)OCCO3
InChI=1SC22H31NO3c11991022(2511122622)1315(19)341617(19)5720(2)18(16)6821(2024)1423h3161824H413H212H3
MFCD20734735
N#C(C@)1(O)CCC2(C@)1(C)CCC1C2CC=C2(C@)1(C)CCC1(C2)OCCO1
ZINC000070669781
ZINC000253527962
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