U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C26H36N2O9
Molecular Weight 520.572
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANTIMYCIN A3A

SMILES

CCCC[C@@H]1[C@@H](OC(=O)[C@@H](C)CC)[C@H](C)OC(=O)[C@@H](NC(=O)C2=C(O)C(NC=O)=CC=C2)[C@@H](C)OC1=O

InChI

InChIKey=RJSDTWRLWCTTTR-AJFXPNBASA-N
InChI=1S/C26H36N2O9/c1-6-8-10-18-22(37-24(32)14(3)7-2)16(5)36-26(34)20(15(4)35-25(18)33)28-23(31)17-11-9-12-19(21(17)30)27-13-29/h9,11-16,18,20,22,30H,6-8,10H2,1-5H3,(H,27,29)(H,28,31)/t14-,15+,16-,18+,20-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H36N2O9
Molecular Weight 520.572
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:07:14 GMT 2025
Edited
by admin
on Mon Mar 31 22:07:14 GMT 2025
Record UNII
DPX3E76665
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANTIMYCIN A3A
MI  
Common Name English
(+)-ANTIMYCIN A3A
Preferred Name English
ANTIMYCIN A3A [MI]
Common Name English
AA3A
Common Name English
(2'S)-ANTIMYCIN A3A
Common Name English
Code System Code Type Description
MERCK INDEX
m1972
Created by admin on Mon Mar 31 22:07:14 GMT 2025 , Edited by admin on Mon Mar 31 22:07:14 GMT 2025
PRIMARY Merck Index
FDA UNII
DPX3E76665
Created by admin on Mon Mar 31 22:07:14 GMT 2025 , Edited by admin on Mon Mar 31 22:07:14 GMT 2025
PRIMARY
EPA CompTox
DTXSID10182346
Created by admin on Mon Mar 31 22:07:14 GMT 2025 , Edited by admin on Mon Mar 31 22:07:14 GMT 2025
PRIMARY
PUBCHEM
76958041
Created by admin on Mon Mar 31 22:07:14 GMT 2025 , Edited by admin on Mon Mar 31 22:07:14 GMT 2025
PRIMARY
CAS
28068-14-6
Created by admin on Mon Mar 31 22:07:14 GMT 2025 , Edited by admin on Mon Mar 31 22:07:14 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY