Vitas-M small molecule compound
(5alpha,8xi,9xi,14xi)-17-oxo-16-(piperidin-1-yl)androstan-3-yl acetate
Catalog ID
STL526575
SMILES CC(=O)OC1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CC(C2=O)N1CCCCC1)C)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 C26H41NO3 MW 415.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H41NO3/c1-17(28)30-19-9-11-25(2)18(15-19)7-8-20-21(25)10-12-26(3)22(20)16-23(24(26)29)27-13-5-4-6-14-27/h18-23H,4-16H2,1-3H3/t18-,19?,20?,21?,22?,23?,25-,26-/m0/s1InChIKey
QZQARKHEFRUGSK-LNSPLOPHSA-NSynonyms
((5~(S)10~(S)13~(S))1013dimethyl17oxo16piperidin1yl1234567891112141516tetradecahydrocyclopenta(a)phenanthren3yl)acetate
(5alpha8xi9xi14xi)17oxo16(piperidin1yl)androstan3ylacetate
(5S10S13S)1013dimethyl17oxo16(piperidin1yl)hexadecahydro1Hcyclopenta(a)phenanthren3ylacetate
16397345
CC(=O)OC1CC(C@)2((C@H)(C1)CCC1C2CC(C@)2(C1CC(C2=O)N1CCCCC1)C)C
InChI=1SC26H41NO3c117(28)301991125(2)18(1519)782021(25)101226(3)22(20)1623(24(26)29)27135461427h1823H416H213H3t1819?20?21?22?23?2526m0s1
MFCD02926136
ZINC000012660433
ZINC000253499904
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