Vitas-M small molecule compound
(3alpha,5beta,12alpha)-3,12-dihydroxy-N-[2-(2-methoxyphenyl)ethyl]cholan-24-amide
Catalog ID
STL538465
SMILES COc1ccccc1CCNC(=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
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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(9-14-31(37)34-18-16-22-7-5-6-8-29(22)38-4)26-12-13-27-25-11-10-23-19-24(35)15-17-32(23,2)28(25)20-30(36)33(26,27)3/h5-8,21,23-28,30,35-36H,9-20H2,1-4H3,(H,34,37)/t21-,23-,24-,25+,26-,27+,28+,30+,32+,33-/m1/s1InChIKey
NBAYLQSUAILDNG-YLXOVGQTSA-NSynonyms
(3alpha5beta12alpha)312dihydroxyN(2(2methoxyphenyl)ethyl)cholan24amide
(4~(R))4((3~(R)5~(R)8~(R)9~(S)10~(S)12~(S)13~(R)14~(S)17~(R))312dihydroxy1013dimethyl23456789111214151617tetradecahydro1~(H)cyclopenta(a)phenanthren17yl)~(N)(2(2methoxyphenyl)ethyl)pentanamide
(R)4((3R5R8R9S10S12S13R14S17R)312dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)N(2methoxyphenethyl)pentanamide
71692041
COc1ccccc1CCNC(=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=1SC33H51NO4c121(91431(37)34181622756829(22)384)26121327251110231924(35)151732(232)28(25)2030(36)33(2627)3h58212328303536H920H214H3(H3437)t21232425+2627+28+30+32+33m1s1
ZINC000072325495
ZINC72325495
Check stock
See real-time availability and sample size for STL538465 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.