41906-06-3
17-HYDROXYPREGNENOLONE 3-ACETATE
Name17-HYDROXYPREGNENOLONE 3-ACETATE
1Identification
【Name】
17-HYDROXYPREGNENOLONE 3-ACETATE
【CAS】
【MDL】
MFCD00046233
【English Synonyms】
【Formula】
C23 H34 O4
【MolWeight】
374.518
【Inchi】
InChI=1S/C23H34O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h5,17-20,26H,6-13H2,1-4H3/t17-,18+,19-,20-,21-,22-,23-/m0/s1
【InChIKey】
InChIKey=IQCNQJXIOWBNAT-KIYFCUGLSA-N
【SMILES】
CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C)O
【MOL File】
17-HYDROXYPREGNENOLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【WGK Germany】
3
4CML File
17-HYDROXYPREGNENOLONE 3-ACETATE.cml