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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H46O7
Molecular Weight 530.6927
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 26-oxofusidic acid

SMILES

C[C@@H]1[C@H](O)CC[C@@]2(C)[C@H]1CC[C@@]3(C)[C@H]2[C@H](O)C[C@H]4\C([C@H](C[C@]34C)OC(C)=O)=C(/CC\C=C(/C)C=O)C(O)=O

InChI

InChIKey=OZMOUWFCJHVIQT-CEDPPNKGSA-N
InChI=1S/C31H46O7/c1-17(16-32)8-7-9-20(28(36)37)26-22-14-24(35)27-29(4)12-11-23(34)18(2)21(29)10-13-30(27,5)31(22,6)15-25(26)38-19(3)33/h8,16,18,21-25,27,34-35H,7,9-15H2,1-6H3,(H,36,37)/b17-8+,26-20-/t18-,21-,22-,23+,24+,25-,27-,29-,30-,31-/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H46O7
Molecular Weight 530.6927
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:09:13 GMT 2025
Edited
by admin
on Wed Apr 02 17:09:13 GMT 2025
Record UNII
DHJ64Z35HB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
26-oxofusidic acid
Common Name English
FUSIDIC ACID IMPURITY F [EP IMPURITY]
Preferred Name English
(3?,4?,8?,9?,11?,13?,14?,16?,17Z)-16-(Acetyloxy)-3,11-dihydroxy-26-oxo-29-nordammara-17(20),24-dien-21-oic acid
Systematic Name English
ent-(17Z,24EZ)-16?-(acetyloxy)-3?,11?-dihydroxy-4?,8,14-trimethyl-26-oxo-18-nor-5?,10?-cholesta-17(20),24-dien-21-oic acid
Systematic Name English
29-Nordammara-17(20),24-dien-21-oic acid, 16-(acetyloxy)-3,11-dihydroxy-26-oxo-, (3?,4?,8?,9?,11?,13?,14?,16?,17Z)-
Systematic Name English
Code System Code Type Description
CAS
1415035-94-7
Created by admin on Wed Apr 02 17:09:13 GMT 2025 , Edited by admin on Wed Apr 02 17:09:13 GMT 2025
PRIMARY
PUBCHEM
90085946
Created by admin on Wed Apr 02 17:09:13 GMT 2025 , Edited by admin on Wed Apr 02 17:09:13 GMT 2025
PRIMARY
FDA UNII
DHJ64Z35HB
Created by admin on Wed Apr 02 17:09:13 GMT 2025 , Edited by admin on Wed Apr 02 17:09:13 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY