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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H46O5
Molecular Weight 474.6725
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 16-Epideacetylfusidic 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](O)C[C@]34C)=C(/CCC=C(C)C)C(O)=O

InChI

InChIKey=ZYPQPWJLUKNCQX-ZYLURJCOSA-N
InChI=1S/C29H46O5/c1-16(2)8-7-9-18(26(33)34)24-20-14-22(31)25-27(4)12-11-21(30)17(3)19(27)10-13-28(25,5)29(20,6)15-23(24)32/h8,17,19-23,25,30-32H,7,9-15H2,1-6H3,(H,33,34)/b24-18-/t17-,19-,20-,21+,22+,23+,25-,27-,28-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H46O5
Molecular Weight 474.6725
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:45:38 GMT 2025
Edited
by admin
on Wed Apr 02 17:45:38 GMT 2025
Record UNII
QL5YA4GBP8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC 319631
Preferred Name English
16-Epideacetylfusidic acid
Common Name English
ent-(17Z)-3?,11?,16?-trihydroxy-4?,8,14-trimethyl-18-nor-5?,10?-cholesta-17(20),24-dien-21-oic acid
Systematic Name English
29-Nordammara-17(20),24-dien-21-oic acid, 3,11,16-trihydroxy-, (3?,4?,8?,9?,11?,13?,14?,16?,17Z)-
Systematic Name English
FUSIDIC ACID IMPURITY I [EP IMPURITY]
Common Name English
(3?,4?,8?,9?,11?,13?,14?,16?,17Z)-3,11,16-Trihydroxy-29-nordammara-17(20),24-dien-21-oic acid
Systematic Name English
Code System Code Type Description
CAS
5951-83-7
Created by admin on Wed Apr 02 17:45:39 GMT 2025 , Edited by admin on Wed Apr 02 17:45:39 GMT 2025
PRIMARY
PUBCHEM
54607638
Created by admin on Wed Apr 02 17:45:39 GMT 2025 , Edited by admin on Wed Apr 02 17:45:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID90714568
Created by admin on Wed Apr 02 17:45:39 GMT 2025 , Edited by admin on Wed Apr 02 17:45:39 GMT 2025
PRIMARY
FDA UNII
QL5YA4GBP8
Created by admin on Wed Apr 02 17:45:39 GMT 2025 , Edited by admin on Wed Apr 02 17:45:39 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY