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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

[H][C@@]12C[C@@H](O)[C@@]3([H])[C@@]4(C)CC[C@@H](O)[C@@H](C)[C@]4([H])CC[C@]3(C)[C@@]1(C)C[C@@H](O)\C2=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 Sat Dec 16 19:55:40 GMT 2023
Edited
by admin
on Sat Dec 16 19:55:40 GMT 2023
Record UNII
QL5YA4GBP8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
16-Epideacetylfusidic acid
Common Name English
ent-(17Z)-3β,11β,16β-trihydroxy-4β,8,14-trimethyl-18-nor-5β,10α-cholesta-17(20),24-dien-21-oic acid
Systematic Name English
NSC 319631
Code English
29-Nordammara-17(20),24-dien-21-oic acid, 3,11,16-trihydroxy-, (3α,4α,8α,9β,11α,13α,14β,16α,17Z)-
Systematic Name English
FUSIDIC ACID IMPURITY I [EP IMPURITY]
Common Name English
(3α,4α,8α,9β,11α,13α,14β,16α,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 Sat Dec 16 19:55:40 GMT 2023 , Edited by admin on Sat Dec 16 19:55:40 GMT 2023
PRIMARY
PUBCHEM
54607638
Created by admin on Sat Dec 16 19:55:40 GMT 2023 , Edited by admin on Sat Dec 16 19:55:40 GMT 2023
PRIMARY
FDA UNII
QL5YA4GBP8
Created by admin on Sat Dec 16 19:55:40 GMT 2023 , Edited by admin on Sat Dec 16 19:55:40 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY