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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H36O4
Molecular Weight 400.5509
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 16.ALPHA.,17-ISOPROPYLIDENEDIOXY-6.ALPHA.-METHYLPROGESTERONE

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])C[C@H](C)C5=CC(=O)CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1(OC(C)(C)O2)C(C)=O

InChI

InChIKey=YWMWIAVBBQGFEY-MTJPYDJLSA-N
InChI=1S/C25H36O4/c1-14-11-17-18(23(5)9-7-16(27)12-19(14)23)8-10-24(6)20(17)13-21-25(24,15(2)26)29-22(3,4)28-21/h12,14,17-18,20-21H,7-11,13H2,1-6H3/t14-,17+,18-,20-,21+,23+,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H36O4
Molecular Weight 400.5509
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:02:22 GMT 2023
Edited
by admin
on Fri Dec 15 15:02:22 GMT 2023
Record UNII
A564VVA55Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
16.ALPHA.,17-ISOPROPYLIDENEDIOXY-6.ALPHA.-METHYLPROGESTERONE
Common Name English
NSC-56948
Code English
PROGESTERONE, 16.ALPHA.,17-DIHYDROXY-6.ALPHA.-METHYL-, CYCLIC 16,17-ACETAL WITH ACETONE
Common Name English
PREGN-4-ENE-3,20-DIONE, 16.ALPHA.,17-DIHYDROXY-6.ALPHA.-METHYL-, CYCLIC ACETAL WITH ACETONE
Common Name English
PREGN-4-ENE-3,20-DIONE, 6-METHYL-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (6.ALPHA.,16.ALPHA.)-
Common Name English
Code System Code Type Description
NSC
56948
Created by admin on Fri Dec 15 15:02:22 GMT 2023 , Edited by admin on Fri Dec 15 15:02:22 GMT 2023
PRIMARY
PUBCHEM
245229
Created by admin on Fri Dec 15 15:02:22 GMT 2023 , Edited by admin on Fri Dec 15 15:02:22 GMT 2023
PRIMARY
FDA UNII
A564VVA55Z
Created by admin on Fri Dec 15 15:02:22 GMT 2023 , Edited by admin on Fri Dec 15 15:02:22 GMT 2023
PRIMARY
CAS
19304-29-1
Created by admin on Fri Dec 15 15:02:22 GMT 2023 , Edited by admin on Fri Dec 15 15:02:22 GMT 2023
PRIMARY