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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H43N13O11
Molecular Weight 701.6894
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TUBERACTINOMYCIN A

SMILES

[H][C@@]1(C[C@H](O)NC(N)=N1)[C@]2([H])NC(=O)\C(NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CNC2=O)NC(=O)C[C@@H](N)[C@H](O)CCN)=C\NC(N)=O

InChI

InChIKey=JCTPGOAHEVLZAB-PRPOONDPSA-N
InChI=1S/C25H43N13O11/c26-2-1-15(41)9(27)3-16(42)32-11-5-30-23(48)18(10-4-17(43)37-24(28)36-10)38-20(45)12(6-31-25(29)49)33-21(46)13(7-39)35-22(47)14(8-40)34-19(11)44/h6,9-11,13-15,17-18,39-41,43H,1-5,7-8,26-27H2,(H,30,48)(H,32,42)(H,33,46)(H,34,44)(H,35,47)(H,38,45)(H3,28,36,37)(H3,29,31,49)/b12-6-/t9-,10-,11+,13+,14+,15-,17+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H43N13O11
Molecular Weight 701.6894
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:12:05 GMT 2023
Edited
by admin
on Sat Dec 16 08:12:05 GMT 2023
Record UNII
6G3YJ6APT4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TUBERACTINOMYCIN A
MI  
Common Name English
VIOMYCIN, 1-((3R,4R)-4-HYDROXY-3,6-DIAMINOHEXANOIC ACID)-
Common Name English
TUBERACTINOMYCIN A [MI]
Common Name English
Code System Code Type Description
CAS
33103-21-8
Created by admin on Sat Dec 16 08:12:05 GMT 2023 , Edited by admin on Sat Dec 16 08:12:05 GMT 2023
PRIMARY
MERCK INDEX
m11253
Created by admin on Sat Dec 16 08:12:05 GMT 2023 , Edited by admin on Sat Dec 16 08:12:05 GMT 2023
PRIMARY Merck Index
FDA UNII
6G3YJ6APT4
Created by admin on Sat Dec 16 08:12:05 GMT 2023 , Edited by admin on Sat Dec 16 08:12:05 GMT 2023
PRIMARY
PUBCHEM
20055057
Created by admin on Sat Dec 16 08:12:05 GMT 2023 , Edited by admin on Sat Dec 16 08:12:05 GMT 2023
PRIMARY