Vitas-M small molecule compound
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
STL474507
SMILES CC12Cc3cnc4n(c3CC1CCC1C2CCC2(C1CCC2(C)O)C)nc1c4cccc1
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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 C28H35N3O MW 429.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N3O/c1-26-15-17-16-29-25-20-6-4-5-7-23(20)30-31(25)24(17)14-18(26)8-9-19-21(26)10-12-27(2)22(19)11-13-28(27,3)32/h4-7,16,18-19,21-22,32H,8-15H2,1-3H3InChIKey
FTUGZSWAYIUGKC-UHFFFAOYSA-NSynonyms
(2aR2bS5S5aS7aS7bS17aS)55a7btrimethyl22a2b3455a677a7b81717atetradecahydro1Hcyclopenta(56)naphtho(12g)indazolo(23a)quinazolin5ol
33a5btrimethyl233a455a5b61515a161717a17btetradecahydro1Hcyclopenta(56)naphtho(12g)indazolo(23a)quinazolin3ol
C(C@)12Cc3cnc4n(c3C(C@@H)1CC(C@@H)1(C@@H)2CC(C@)2((C@H)1CC(C@)2(C)O)C)nc1c4cccc1
CC12CCC3C(C1CCC2(C)O)CCC4C3(CC5=C(C4)N6C(=C7C=CC=CC7=N6)N=C5)C
InChI=1SC28H35N3Oc126151716292520645723(20)3031(25)24(17)1418(26)891921(26)101227(2)22(19)111328(273)32h47161819212232H815H213H3
MFCD31751233
ZINC000334161640
ZINC000334161644
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