Vitas-M small molecule compound
(5alpha,8xi,9xi,14xi,17Z)-17-(2-acetylhydrazinylidene)androstan-3-yl acetate
Catalog ID
STL548562
SMILES CC(=O)OC1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CC/C/2=N/NC(=O)C)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 C23H36N2O3 MW 388.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H36N2O3/c1-14(26)24-25-21-8-7-19-18-6-5-16-13-17(28-15(2)27)9-11-22(16,3)20(18)10-12-23(19,21)4/h16-20H,5-13H2,1-4H3,(H,24,26)/b25-21-/t16-,17?,18?,19?,20?,22-,23-/m0/s1InChIKey
JTSYJYALWDMECW-VCNITULRSA-NSynonyms
((5~(S)10~(S)13~(S)17~(Z))17(acetylhydrazinylidene)1013dimethyl1234567891112141516tetradecahydrocyclopenta(a)phenanthren3yl)acetate
(5alpha8xi9xi14xi17Z)17(2acetylhydrazinylidene)androstan3ylacetate
(5S10S13SZ)17(2acetylhydrazono)1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren3ylacetate
16399998
CC(=O)OC1CC(C@)2((C@H)(C1)CCC1C2CC(C@)2(C1CCC2=NNC(=O)C)C)C
InChI=1SC23H36N2O3c114(26)24252187191865161317(2815(2)27)91122(163)20(18)101223(1921)4h1620H513H214H3(H2426)b2521t1617?18?19?20?2223m0s1
MFCD02059115
ZINC000032116337
ZINC000253498675
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