58652-19-0
17ALPHA-ACETOXY-6-METHYLENE-19-NORPREGN-4-EN-3,20-DIONE
Name
17ALPHA-ACETOXY-6-METHYLENE-19-NORPREGN-4-EN-3,20-DIONE
Formula
C23 H30 O4
MolWeight
370.486
1Identification
【Name】
17ALPHA-ACETOXY-6-METHYLENE-19-NORPREGN-4-EN-3,20-DIONE
【CAS】
【MDL】
MFCD09038717
【English Synonyms】
【Formula】
C23 H30 O4
【MolWeight】
370.486
【Inchi】
InChI=1S/C23H30O4/c1-13-11-20-18(17-6-5-16(26)12-19(13)17)7-9-22(4)21(20)8-10-23(22,14(2)24)27-15(3)25/h12,17-18,20-21H,1,5-11H2,2-4H3/t17-,18-,20-,21+,22+,23+/m1/s1
【InChIKey】
InChIKey=YBBDZPBFRFPTJE-YQLZSBIMSA-N
【SMILES】
CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=C)C4=CC(=O)CC[C@H]34)C)OC(=O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
17ALPHA-ACETOXY-6-METHYLENE-19-NORPREGN-4-EN-3,20-DIONE.cml
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