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

Details

Stereochemistry ABSOLUTE
Molecular Formula C6H10O7.H2O
Molecular Weight 212.1547
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-D-GALACTURONIC ACID MONOHYDRATE

SMILES

O.O[C@H]1O[C@@H]([C@H](O)[C@H](O)[C@H]1O)C(O)=O

InChI

InChIKey=BGHPCEJXDOGRGW-JPOZLJPYSA-N
InChI=1S/C6H10O7.H2O/c7-1-2(8)4(5(10)11)13-6(12)3(1)9;/h1-4,6-9,12H,(H,10,11);1H2/t1-,2+,3+,4-,6-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H10O7
Molecular Weight 194.1394
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q3ZFI7
Gene ID: NA
Gene Symbol: gar1
Target Organism: Hypocrea jecorina (Trichoderma reesei)
Target ID: O49133
Gene ID: NA
Gene Symbol: GALUR
Target Organism: Fragaria ananassa (Strawberry)
Substance Class Chemical
Created
by admin
on Sat Dec 16 19:09:24 GMT 2023
Edited
by admin
on Sat Dec 16 19:09:24 GMT 2023
Record UNII
HU26LP8S4X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-D-GALACTURONIC ACID MONOHYDRATE
Common Name English
D-GALACTURONIC ACID .ALPHA.-FORM MONOHYDRATE [MI]
Common Name English
Code System Code Type Description
CAS
71662-12-9
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
NON-SPECIFIC STOICHIOMETRY
CAS
91510-62-2
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
91872458
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
PRIMARY
FDA UNII
HU26LP8S4X
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
PRIMARY
CAS
334697-28-8
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID00919688
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
PRIMARY
MERCK INDEX
m5637
Created by admin on Sat Dec 16 19:09:25 GMT 2023 , Edited by admin on Sat Dec 16 19:09:25 GMT 2023
PRIMARY
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