U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32O6
Molecular Weight 416.5073
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-DEMETHYL-6-(HYDROXYMETHYL)-2.ALPHA.-HYDROXY MEGESTROL ACETATE

SMILES

[H][C@@]12CC[C@](OC(C)=O)(C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])C=C(CO)C4=CC(=O)[C@H](O)C[C@]34C

InChI

InChIKey=CIAVXSJHJPXIQJ-MXMIKBQFSA-N
InChI=1S/C24H32O6/c1-13(26)24(30-14(2)27)8-6-18-16-9-15(12-25)19-10-20(28)21(29)11-22(19,3)17(16)5-7-23(18,24)4/h9-10,16-18,21,25,29H,5-8,11-12H2,1-4H3/t16-,17+,18+,21-,22-,23+,24+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
6-DEMETHYL-6-(HYDROXYMETHYL)-2.ALPHA.-HYDROXY MEGESTROL ACETATE
Common Name English
17.ALPHA.-ACETOXY-2.ALPHA.-HYDROXY-6-HYDROXYMETHYLPREGNA-4,6-DIENE-3,20-DIONE
Systematic Name English
17.ALPHA.-ACETOXY-2.ALPHA.-HYDROXY-6-(HYDROXYMETHYL)PREGNA-4,6-DIENE-3,20-DIONE
Systematic Name English
PREGNA-4,6-DIENE-3,20-DIONE, 17-(ACETYLOXY)-2-HYDROXY-6-(HYDROXYMETHYL)-, (2.ALPHA.)-
Systematic Name English
PREGNA-4,6-DIENE-3,20-DIONE, 2.ALPHA.,17-DIHYDROXY-6-(HYDROXYMETHYL)-, 17-ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
DZ5I9Q768J
Created by admin on Sat Dec 16 09:33:15 GMT 2023 , Edited by admin on Sat Dec 16 09:33:15 GMT 2023
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CAS
1867-40-9
Created by admin on Sat Dec 16 09:33:15 GMT 2023 , Edited by admin on Sat Dec 16 09:33:15 GMT 2023
PRIMARY
PUBCHEM
91810496
Created by admin on Sat Dec 16 09:33:15 GMT 2023 , Edited by admin on Sat Dec 16 09:33:15 GMT 2023
PRIMARY