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CHEBI:35333 - 4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid

ChEBI IDCHEBI:35333
ChEBI Name4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid
Stars
ASCII Name4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid
Last Modified28 February 2013
DownloadsMolfile
FormulaC12H16O12
Net Charge0
Average Mass352.248
Monoisotopic Mass352.06418
SMILESO=C(O)C1=C[C@H](O)[C@@H](O)C(O[C@@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2C(=O)O)O1
WURCSWURCS=2.0/1,1,0/[a2112A-1x_1-5_4*OC^XC^RC^SC=^XCCO/8=O/7O$3/5O/4O]/1/
InChIInChI=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
InChIKeyLLVVMXFNKAHVEZ-NYRKXTQQSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:35333) is a galacturonic acids (CHEBI:33808)
Incoming Relation(s)
4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:27450) 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 a 4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:35333)
IUPAC Name 
4-O-(4-deoxy-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid