MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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UDP-alpha-D-galacturonate

	Properties	Image
MNX_ID	MNXM1092
reference	chebi:57635
formula	C₁₅H₁₉N₂O₁₈P₂
global charge	-3
mol weight	577.261
InChIKey	HDYANYHVCAPMJV-GXNRKQDOSA-K
InChI	InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/p-3/t4-,6-,7+,8-,9-,10-,11+,12-,14-/m1/s1
SMILES	O=C1C=CN([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])O[C@H]3O[C@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)C(=O)N1

MNX internals

InChI (mnx)	InChI=1/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8-,9-,10-,11+,12-,14-/m1/s1
SMILES (mnx)	[CH:1]1=[CH:2][N:17]([C@H:12]2[C@H:9]([OH:22])[C@H:6]([OH:19])[C@@H:4]([CH2:3][O:31][P:36]([OH:27])(=[O:28])[O:35][P:37]([OH:29])(=[O:30])[O:34][C@@H:14]3[C@H:10]([OH:23])[C@@H:7]([OH:20])[C@@H:8]([OH:21])[C@@H:11]([C:13](=[O:24])[OH:25])[O:33]3)[O:32]2)[C:15](=[O:26])[N:16]=[C:5]1[OH:18]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	15
in models (compartimentalized)	5

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57635 chebi:57635 HDYANYHVCAPMJV-GXNRKQDOSA-K	UDP-alpha-D-galacturonate UDP-alpha-D-galacturonate trianion UDP-alpha-D-galacturonate(3-)
sabiork.compound:2116 sabiorkM:2116 HDYANYHVCAPMJV-GXNRKQDOSA-N	UDP-D-galacturonate
kegg.glycan:G11110 keggG:G11110	UDP-D-galacturonate UDP-D-galacturonic acid
kegg.compound:C00617 keggC:C00617 HDYANYHVCAPMJV-RDKSFWDPSA-N	UDP-D-galacturonate UDP-alpha-D-galacturonate UDPgalacturonate
hmdb:HMDB0012302 HDYANYHVCAPMJV-GXNRKQDOSA-N	UDP-D-galacturonic acid (2S,3R,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid UDP-D-Galacturonate UDP-D-Galacturonic acid UDP-Gal-ua UDP-GalA UDP-a-D-Galacturonate UDP-a-D-Galacturonic acid UDP-alpha-D-Galacturonate UDP-alpha-D-galacturonate UDP-alpha-D-galacturonic acid UDP-galacturonic acid UDPGalAc UDPGalurAc UDPgalacturonate UDPgalacturonic acid Uridine 5'-(a-D-galactopyranosyluronate pyrophosphate) Uridine 5'-(a-D-galactopyranosyluronic acid pyrophosphoric acid) Uridine 5'-(alpha-D-galactopyranosyluronate pyrophosphate) Uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphate) Uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphoric acid) Uridine diphosphate galacturonic acid Uridine diphosphogalacturonic acid Uridine pyrophosphate galacturonic acid udp-galacturonic acid
CHEBI:13488 chebi:13488	UDP-D-galacturonic acid uridine 5'-[3-(D-galacturonosyl) dihydrogen diphosphate]
metacyc.compound:UDP-D-GALACTURONATE metacycM:UDP-D-GALACTURONATE HDYANYHVCAPMJV-GXNRKQDOSA-K	UDP-alpha-D-galacturonate
CHEBI:16085 chebi:16085 HDYANYHVCAPMJV-GXNRKQDOSA-N	UDP-alpha-D-galacturonic acid UDP-D-galacturonate UDPgalacturonate uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphate) uridine 5'-[3-(alpha-D-galactopyranuronosyl) dihydrogen diphosphate]
bigg.metabolite:udpgalur biggM:udpgalur vmhM:udpgalur vmhmetabolite:udpgalur HDYANYHVCAPMJV-GXNRKQDOSA-N	UDPgalacturonate
seed.compound:cpd00472 seedM:cpd00472 HDYANYHVCAPMJV-GXNRKQDOSA-K	UDPgalacturonate UDP-D-galacturonate UDP-D-galacturonic acid UDP-alpha-D-galacturonate UDP-galacturonate udpgalur
hmdb:HMDB12302 chebi:22101 chebi:9812 biggM:M_udpgalur keggC:M_C00617 keggG:M_G11110 seedM:M_cpd00472 vmhM:M_udpgalur	secondary/obsolete/fantasy identifier