Vitas-M small molecule compound
3,7-dihydroxy-N-(4-methoxyphenyl)cholan-24-amide
Catalog ID
STL470839
SMILES COc1ccc(cc1)NC(=O)CCC(C1CCC2C1(C)CCC1C2C(O)CC2C1(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 C31H47NO4 MW 497.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H47NO4/c1-19(5-12-28(35)32-21-6-8-23(36-4)9-7-21)24-10-11-25-29-26(14-16-31(24,25)3)30(2)15-13-22(33)17-20(30)18-27(29)34/h6-9,19-20,22,24-27,29,33-34H,5,10-18H2,1-4H3,(H,32,35)InChIKey
SLDMGRWQYJUQTC-UHFFFAOYSA-NSynonyms
(R)4((3R5S7S8R9S10S13R14S17R)37dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)N(4methoxyphenyl)pentanamide
37dihydroxyN(4methoxyphenyl)cholan24amide
4(37dihydroxy1013dimethyl23456789111214151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)N(4methoxyphenyl)pentanamide
CC(CCC(=O)NC1=CC=C(C=C1)OC)C2CCC3C2(CCC4C3C(CC5C4(CCC(C5)O)C)O)C
COc1ccc(cc1)NC(=O)CC(C@H)((C@H)1CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2(C@@H)(O)C(C@H)2(C@)1(C)CC(C@H)(C2)O)C
InChI=1SC31H47NO4c119(51228(35)32216823(364)9721)241011252926(141631(2425)3)30(2)151322(33)1720(30)1827(29)34h691920222427293334H51018H214H3(H3235)
MFCD31751143
ZINC000334162386
ZINC000334162389
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.