Vitas-M small molecule compound
3,7-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]cholan-24-amide
Catalog ID
STL470808
SMILES COc1ccc(cc1)CCNC(=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 C33H51NO4 MW 525.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H51NO4/c1-21(5-12-30(37)34-18-15-22-6-8-25(38-4)9-7-22)26-10-11-27-31-28(14-17-33(26,27)3)32(2)16-13-24(35)19-23(32)20-29(31)36/h6-9,21,23-24,26-29,31,35-36H,5,10-20H2,1-4H3,(H,34,37)InChIKey
HCEFOXDFPSSZIP-UHFFFAOYSA-NSynonyms
(R)4((3R5S7S8R9S10S13R14S17R)37dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)N(4methoxyphenethyl)pentanamide
37dihydroxyN(2(4methoxyphenyl)ethyl)cholan24amide
4(37dihydroxy1013dimethyl23456789111214151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)N(2(4methoxyphenyl)ethyl)pentanamide
CC(CCC(=O)NCCC1=CC=C(C=C1)OC)C2CCC3C2(CCC4C3C(CC5C4(CCC(C5)O)C)O)C
COc1ccc(cc1)CCNC(=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=1SC33H51NO4c121(51230(37)341815226825(384)9722)261011273128(141733(2627)3)32(2)161324(35)1923(32)2029(31)36h692123242629313536H51020H214H3(H3437)
MFCD31751114
ZINC000334161702
ZINC000334161707
Check stock
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Check stock on Vitas-MAvailable files
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