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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32N2O9
Molecular Weight 492.5189
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANTIMYCIN A5B

SMILES

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

InChI

InChIKey=UYYBNWFGENCEMV-PLCCHYODSA-N
InChI=1S/C24H32N2O9/c1-6-15-21(35-18(28)10-12(2)3)14(5)34-24(32)19(13(4)33-23(15)31)26-22(30)16-8-7-9-17(20(16)29)25-11-27/h7-9,11-15,19,21,29H,6,10H2,1-5H3,(H,25,27)(H,26,30)/t13-,14+,15-,19+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H32N2O9
Molecular Weight 492.5189
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 08:10:38 UTC 2023
Edited
by admin
on Sat Dec 16 08:10:38 UTC 2023
Record UNII
TA2V73J33Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANTIMYCIN A5B
Common Name English
ISOVALERIC ACID, N-ESTER WITH N-(7-ETHYL-8-HYDROXY-4,9-DIMETHYL-2,6-DIOXO-1,5-DIOXONAN-3-YL)-3-FORMAMIDOSALICYLAMIDE
Systematic Name English
BUTANOIC ACID, 3-METHYL-, 8-ETHYL-3-((3-(FORMYLAMINO)-2-HYDROXYBENZOYL)AMINO)-2,6-DIMETHYL-4,9-DIOXO-1,5-DIOXONAN-7-YL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
TA2V73J33Z
Created by admin on Sat Dec 16 08:10:38 UTC 2023 , Edited by admin on Sat Dec 16 08:10:38 UTC 2023
PRIMARY
PUBCHEM
86278142
Created by admin on Sat Dec 16 08:10:38 UTC 2023 , Edited by admin on Sat Dec 16 08:10:38 UTC 2023
PRIMARY
CAS
27220-60-6
Created by admin on Sat Dec 16 08:10:38 UTC 2023 , Edited by admin on Sat Dec 16 08:10:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID301101084
Created by admin on Sat Dec 16 08:10:38 UTC 2023 , Edited by admin on Sat Dec 16 08:10:38 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY