Vitas-M small molecule compound
N-cyclopropyl-3,7-dihydroxycholan-24-amide
Catalog ID
STL470837
SMILES OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)NC1CC1)C)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 C27H45NO3 MW 431.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H45NO3/c1-16(4-9-24(31)28-18-5-6-18)20-7-8-21-25-22(11-13-27(20,21)3)26(2)12-10-19(29)14-17(26)15-23(25)30/h16-23,25,29-30H,4-15H2,1-3H3,(H,28,31)InChIKey
DYVCWIDNNCVUOG-UHFFFAOYSA-NSynonyms
(R)Ncyclopropyl4((3R5S7S8R9S10S13R14S17R)37dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)pentanamide
CC(CCC(=O)NC1CC1)C2CCC3C2(CCC4C3C(CC5C4(CCC(C5)O)C)O)C
InChI=1SC27H45NO3c116(4924(31)28185618)2078212522(111327(2021)3)26(2)121019(29)1417(26)1523(25)30h1623252930H415H213H3(H2831)
MFCD31751141
Ncyclopropyl37dihydroxycholan24amide
Ncyclopropyl4(37dihydroxy1013dimethyl23456789111214151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)pentanamide
O(C@@H)1CC(C@)2((C@@H)(C1)C(C@@H)((C@@H)1(C@@H)2CC(C@)2((C@H)1CC(C@@H)2(C@@H)(CCC(=O)NC1CC1)C)C)O)C
ZINC000334161601
ZINC000334161605
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