Vitas-M small molecule compound
(10R,13S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one (non-preferred name)
Catalog ID
STL557822
SMILES C#C[C@]1(O)CCC2[C@]1(CC)CCC1C2CCC2=CC(=O)CC[C@H]12
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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 C21H28O2 MW 312.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3/t16-,17?,18?,19?,20-,21-/m0/s1InChIKey
WWYNJERNGUHSAO-RYHLCRTJSA-NSynonyms
(10~(R)13~(S)17~(R))13ethyl17ethynyl17hydroxy126789101112141516dodecahydrocyclopenta(a)phenanthren3one
(10R13S17R)13ethyl17ethynyl17hydroxy1267891011121314151617tetradecahydro3Hcyclopenta(a)phenanthren3one(nonpreferredname)
5702096
InChI=1SC21H28O2c132011917168615(22)1314(16)5718(17)19(20)101221(2023)42h213161923H3512H21H3t1617?18?19?2021m0s1
MFCD31751944
NORGESTREL
ZINC000022065395
ZINC000253498282
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