5566-13-2
6-METHYL-17ALPHA-HYDROXYPREGNENOLONE
Name6-METHYL-17ALPHA-HYDROXYPREGNENOLONE
1Identification
【Name】
6-METHYL-17ALPHA-HYDROXYPREGNENOLONE
【CAS】
【MDL】
MFCD00046232
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C22 H34 O3
【pro_molWeight】
346.508
【Inchi】
InChI=1S/C22H34O3/c1-13-11-16-17(20(3)8-5-15(24)12-19(13)20)6-9-21(4)18(16)7-10-22(21,25)14(2)23/h15-18,24-25H,5-12H2,1-4H3/t15-,16+,17-,18-,20+,21-,22-/m0/s1
【InChIKey】
InChIKey=GJUIWZUADCWWOP-AIOPYVAHSA-N
【SMILES】
CC1=C2C[C@H](CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C1)CC[C@@]4(C(=O)C)O)C)C)O
【MOL File】
6-METHYL-17ALPHA-HYD….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:3
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
6-METHYL-17ALPHA-HYDROXYPREGNENOLONE.cml