Vitas-M small molecule compound
11-bromo-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
STL474511
SMILES Brc1ccc2c(c1)nn1c2ncc2c1CC1CCC3C(C1(C2)C)CCC1(C3CCC1(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 C28H34BrN3O MW 508.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34BrN3O/c1-26-14-16-15-30-25-20-7-5-18(29)13-23(20)31-32(25)24(16)12-17(26)4-6-19-21(26)8-10-27(2)22(19)9-11-28(27,3)33/h5,7,13,15,17,19,21-22,33H,4,6,8-12,14H2,1-3H3InChIKey
WWZIBCPSWFIQDD-UHFFFAOYSA-NSynonyms
(2aR2bS5S5aS7aS7bS17aS)13bromo55a7btrimethyl22a2b3455a677a7b81717atetradecahydro1Hcyclopenta(56)naphtho(12g)indazolo(23a)quinazolin5ol
11bromo33a5btrimethyl233a455a5b61515a161717a17btetradecahydro1Hcyclopenta(56)naphtho(12g)indazolo(23a)quinazolin3ol
Brc1ccc2c(c1)nn1c2ncc2c1C(C@@H)1CC(C@@H)3(C@@H)((C@)1(C2)C)CC(C@)1((C@H)3CC(C@)1(C)O)C
CC12CCC3C(C1CCC2(C)O)CCC4C3(CC5=C(C4)N6C(=C7C=CC(=CC7=N6)Br)N=C5)C
InChI=1SC28H34BrN3Oc1261416153025207518(29)1323(20)3132(25)24(16)1217(26)461921(26)81027(2)22(19)91128(273)33h5713151719212233H4681214H213H3
MFCD31751234
ZINC000334162688
ZINC000334162691
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