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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H36N2O9
Molecular Weight 520.572
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANTIMYCIN A3B

SMILES

CCCC[C@@H]1[C@@H](OC(=O)CC(C)C)[C@H](C)OC(=O)[C@@H](NC(=O)C2=CC=CC(NC=O)=C2O)[C@@H](C)OC1=O

InChI

InChIKey=PVEVXUMVNWSNIG-PDPGNHKXSA-N
InChI=1S/C26H36N2O9/c1-6-7-9-18-23(37-20(30)12-14(2)3)16(5)36-26(34)21(15(4)35-25(18)33)28-24(32)17-10-8-11-19(22(17)31)27-13-29/h8,10-11,13-16,18,21,23,31H,6-7,9,12H2,1-5H3,(H,27,29)(H,28,32)/t15-,16+,18-,21+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C26H36N2O9
Molecular Weight 520.572
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
UK-2A, B, C and D, novel antifungal antibiotics from Streptomyces sp. 517-02. VI(1). Structure-activity relationships of UK-2A.
2001 Jul
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 20:02:31 GMT 2023
Edited
by admin
on Fri Dec 15 20:02:31 GMT 2023
Record UNII
97YBD5W80B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANTIMYCIN A3B
MI  
Common Name English
BUTANOIC ACID, 3-METHYL-, (2R,3S,6S,7R,8R)-8-BUTYL-3-((3-(FORMYLAMINO)-2-HYDROXYBENZOYL)AMINO)-2,6-DIMETHYL-9-OXO-1,5-DIOXONAN-7-YL ESTER
Systematic Name English
ANTIMYCIN A3B [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m1972
Created by admin on Fri Dec 15 20:02:31 GMT 2023 , Edited by admin on Fri Dec 15 20:02:31 GMT 2023
PRIMARY Merck Index
CAS
116095-17-1
Created by admin on Fri Dec 15 20:02:31 GMT 2023 , Edited by admin on Fri Dec 15 20:02:31 GMT 2023
PRIMARY
PUBCHEM
245869
Created by admin on Fri Dec 15 20:02:31 GMT 2023 , Edited by admin on Fri Dec 15 20:02:31 GMT 2023
PRIMARY
FDA UNII
97YBD5W80B
Created by admin on Fri Dec 15 20:02:31 GMT 2023 , Edited by admin on Fri Dec 15 20:02:31 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY