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

Details

Stereochemistry ABSOLUTE
Molecular Formula C45H74O11
Molecular Weight 791.0625
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OLIGOMYCIN A

SMILES

CC[C@@H]1CC[C@@H]2O[C@]3(CC[C@H](C)[C@H](C[C@@H](C)O)O3)[C@@H](C)[C@H](OC(=O)\C=C\[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@](C)(O)[C@@H](O)[C@H](C)C\C=C\C=C\1)[C@@H]2C

InChI

InChIKey=MNULEGDCPYONBU-AWJDAWNUSA-N
InChI=1S/C45H74O11/c1-12-34-17-15-13-14-16-27(4)42(51)44(11,53)43(52)32(9)40(50)31(8)39(49)30(7)38(48)26(3)18-21-37(47)54-41-29(6)35(20-19-34)55-45(33(41)10)23-22-25(2)36(56-45)24-28(5)46/h13-15,17-18,21,25-36,38,40-42,46,48,50-51,53H,12,16,19-20,22-24H2,1-11H3/b14-13+,17-15+,21-18+/t25-,26-,27+,28+,29+,30-,31-,32-,33-,34-,35-,36-,38+,40+,41+,42-,44+,45-/m0/s1

HIDE SMILES / InChI

Molecular Formula C45H74O11
Molecular Weight 791.0625
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 18 / 18
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:54:22 GMT 2023
Edited
by admin
on Fri Dec 15 18:54:22 GMT 2023
Record UNII
05HQS4AI99
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OLIGOMYCIN A
MI  
Common Name English
MCH 32
Code English
NSC-717694
Code English
OLIGOMYCIN A [MI]
Common Name English
MCH-32
Code English
Code System Code Type Description
NSC
717694
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
CHEBI
28285
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
FDA UNII
05HQS4AI99
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-437-3
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
MESH
C031004
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID80891317
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
MERCK INDEX
m8197
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY Merck Index
CAS
579-13-5
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY
PUBCHEM
52947716
Created by admin on Fri Dec 15 18:54:22 GMT 2023 , Edited by admin on Fri Dec 15 18:54:22 GMT 2023
PRIMARY