CHEBI:15863 - 4-(4-deoxy-β-D-gluc-4-enosyluronic acid)-D-galacturonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-(4-deoxy-β-D-gluc-4-enosyluronic acid)-D-galacturonic acid
ChEBI ID CHEBI:15863
ChEBI ASCII Name 4-(4-deoxy-beta-D-gluc-4-enosyluronic acid)-D-galacturonic acid
Definition A D-galacturonic acid having a 4-deoxy-α-L-threo-hex-4-enopyranosyluronic acid moiety attached at the 4-position.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1768, CHEBI:11934, CHEBI:20291
Supplier Information
Download Molfile XML SDF
Formula C12H16O12
Net Charge 0
Average Mass 352.24820
Monoisotopic Mass 352.06418
InChI InChI=1S/C12H16O12/c13-2-1-3(9(17)18)22-12(4(2)14)24-7-5(15)6(16)11(21)23-8(7)10(19)20/h1-2,4-8,11-16,21H,(H,17,18)(H,19,20)/t2-,4+,5+,6+,7+,8-,11?,12-/m0/s1
InChIKey LLVVMXFNKAHVEZ-HFKJOTJWSA-N
SMILES OC1O[C@@H]([C@H](O[C@@H]2OC(=C[C@H](O)[C@H]2O)C(O)=O)[C@H](O)[C@H]1O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-(4-deoxy-β-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:15863) is a 4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:35333)
4-(4-deoxy-β-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:15863) is conjugate acid of 4-(4-deoxy-β-D-gluc-4-enosyluronate)-D-galacturonate(2−) (CHEBI:57544)
Incoming 4-(4-deoxy-β-D-gluc-4-enosyluronate)-D-galacturonate(2−) (CHEBI:57544) is conjugate base of 4-(4-deoxy-β-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:15863)
IUPAC Name
4-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid
Synonym Source
4-(4-Deoxy-beta-D-gluc-4-enuronosyl)-D-galacturonate KEGG COMPOUND
Manual Xrefs Databases
C04733 KEGG COMPOUND
G10586 KEGG GLYCAN
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Last Modified
23 December 2018