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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H22O3
Molecular Weight 298.3762
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Oxo Boldione

SMILES

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

InChI

InChIKey=BXPQXTJWPDQYMP-IEVKOWOJSA-N
InChI=1S/C19H22O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h5,7,9,12-14H,3-4,6,8,10H2,1-2H3/t12-,13-,14-,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H22O3
Molecular Weight 298.3762
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:28:16 GMT 2023
Edited
by admin
on Sat Dec 16 11:28:16 GMT 2023
Record UNII
M4HGN4ER3M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-Oxo Boldione
Common Name English
Androsta-1,4-diene-3,6,17-trione
Systematic Name English
EXEMESTANE IMPURITY F [EP IMPURITY]
Common Name English
FCE-24204
Code English
Code System Code Type Description
FDA UNII
M4HGN4ER3M
Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023
PRIMARY
CAS
72648-46-5
Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023
PRIMARY
PUBCHEM
135516
Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY