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

Details

Stereochemistry ABSOLUTE
Molecular Formula C6H10O5
Molecular Weight 162.1406
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-DEOXYGLUCOSONE

SMILES

OC[C@@H](O)[C@@H](O)CC(=O)C=O

InChI

InChIKey=ZGCHLOWZNKRZSN-NTSWFWBYSA-N
InChI=1S/C6H10O5/c7-2-4(9)1-5(10)6(11)3-8/h2,5-6,8,10-11H,1,3H2/t5-,6+/m0/s1

HIDE SMILES / InChI

Molecular Formula C6H10O5
Molecular Weight 162.1406
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:41:21 GMT 2023
Edited
by admin
on Sat Dec 16 08:41:21 GMT 2023
Record UNII
EXV5374VEY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-DEOXYGLUCOSONE
Common Name English
3-DEOXY-D-GLUCOSONE
Common Name English
2-KETO-3-DEOXYGLUCOSE
Common Name English
3-DEOXY-D-ERYTHRO-HEXOSULOSE
Common Name English
D-ERYTHRO-HEXOS-2-ULOSE, 3-DEOXY-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
3-Deoxyglucosone
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
PRIMARY
CHEBI
60777
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID00193820
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
PRIMARY
CAS
624740-14-3
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
ALTERNATIVE
CAS
4084-27-9
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
PRIMARY
FDA UNII
EXV5374VEY
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
PRIMARY
PUBCHEM
114839
Created by admin on Sat Dec 16 08:41:21 GMT 2023 , Edited by admin on Sat Dec 16 08:41:21 GMT 2023
PRIMARY