Vitas-M small molecule compound
9-fluoro-3,3a,5b-trimethyl-2,3,3a,4,5,5a,5b,6,15,15a,16,17,17a,17b-tetradecahydro-1H-cyclopenta[5,6]naphtho[1,2-g]indazolo[2,3-a]quinazolin-3-ol
Catalog ID
STL474508
SMILES Fc1cccc2c1c1ncc3c(n1n2)CC1C(C3)(C)C2CCC3(C(C2CC1)CCC3(C)O)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 C28H34FN3O MW 447.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34FN3O/c1-26-14-16-15-30-25-24-21(29)5-4-6-22(24)31-32(25)23(16)13-17(26)7-8-18-19(26)9-11-27(2)20(18)10-12-28(27,3)33/h4-6,15,17-20,33H,7-14H2,1-3H3InChIKey
DAWPFPOCBDCGER-UHFFFAOYSA-NSynonyms
(2aR2bS5S5aS7aS7bS17aS)11fluoro55a7btrimethyl22a2b3455a677a7b81717atetradecahydro1Hcyclopenta(56)naphtho(12g)indazolo(23a)quinazolin5ol
9fluoro33a5btrimethyl233a455a5b61515a161717a17btetradecahydro1Hcyclopenta(56)naphtho(12g)indazolo(23a)quinazolin3ol
CC12CCC3C(C1CCC2(C)O)CCC4C3(CC5=C(C4)N6C(=C7C(=N6)C=CC=C7F)N=C5)C
Fc1cccc2c1c1ncc3c(n1n2)C(C@H)1(C@@)(C3)(C)(C@H)2CC(C@)3((C@H)((C@@H)2CC1)CC(C@)3(C)O)C
InChI=1SC28H34FN3Oc12614161530252421(29)54622(24)3132(25)23(16)1317(26)781819(26)91127(2)20(18)101228(273)33h4615172033H714H213H3
MFCD31538062
ZINC000334161527
ZINC000334161535
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