Vitas-M small molecule compound
3,7-dihydroxy-24-[4-(pyridin-2-yl)piperazin-1-yl]cholan-24-one
Catalog ID
STL470850
SMILES OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)N1CCN(CC1)c1ccccn1)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 C33H51N3O3 MW 537.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H51N3O3/c1-22(7-10-30(39)36-18-16-35(17-19-36)29-6-4-5-15-34-29)25-8-9-26-31-27(12-14-33(25,26)3)32(2)13-11-24(37)20-23(32)21-28(31)38/h4-6,15,22-28,31,37-38H,7-14,16-21H2,1-3H3InChIKey
HUNMKYSNJWDJOJ-UHFFFAOYSA-NSynonyms
(R)4((3R5S7S8R9S10S13R14S17R)37dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)1(4(pyridin2yl)piperazin1yl)pentan1one
37dihydroxy24(4(pyridin2yl)piperazin1yl)cholan24one
4(37dihydroxy1013dimethyl23456789111214151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)1(4pyridin2ylpiperazin1yl)pentan1one
CC(CCC(=O)N1CCN(CC1)C2=CC=CC=N2)C3CCC4C3(CCC5C4C(CC6C5(CCC(C6)O)C)O)C
InChI=1SC33H51N3O3c122(71030(39)36181635(171936)29645153429)2589263127(121433(2526)3)32(2)131124(37)2023(32)2128(31)38h46152228313738H7141621H213H3
MFCD31751151
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)N1CCN(CC1)c1ccccn1)C)C)O)C
ZINC000334161773
ZINC000334161776
Check stock
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