Vitas-M small molecule compound
3,12-dihydroxy-24-[4-(2-methoxyphenyl)piperazin-1-yl]cholan-24-one
Catalog ID
STL511736
SMILES COc1ccccc1N1CCN(CC1)C(=O)CCC(C1CCC2C1(C)C(O)CC1C2CCC2C1(C)CCC(C2)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 C35H54N2O4 MW 566.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H54N2O4/c1-23(9-14-33(40)37-19-17-36(18-20-37)30-7-5-6-8-31(30)41-4)27-12-13-28-26-11-10-24-21-25(38)15-16-34(24,2)29(26)22-32(39)35(27,28)3/h5-8,23-29,32,38-39H,9-22H2,1-4H3InChIKey
GAKKRKUXTIECME-UHFFFAOYSA-NSynonyms
(R)4((3R5R8R9S10S12S13R14S17R)312dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)1(4(2methoxyphenyl)piperazin1yl)pentan1one
312dihydroxy24(4(2methoxyphenyl)piperazin1yl)cholan24one
4(312dihydroxy1013dimethyl23456789111214151617tetradecahydro1~(H)cyclopenta(a)phenanthren17yl)1(4(2methoxyphenyl)piperazin1yl)pentan1one
78149804
COc1ccccc1N1CCN(CC1)C(=O)CC(C@H)((C@H)1CC(C@@H)2(C@)1(C)(C@@H)(O)C(C@H)1(C@H)2CC(C@H)2(C@)1(C)CC(C@H)(C2)O)C
InChI=1SC35H54N2O4c123(91433(40)37191736(182037)30756831(30)414)27121328261110242125(38)151634(242)29(26)2232(39)35(2728)3h582329323839H922H214H3
MFCD31751809
ZINC000504744311
ZINC000504744314
Check stock
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