UCSF

ZINC30320690

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2009 37 No

Popular Name: Uridine diphosphate glucuronic acid Uridine diphosphate glucuronic acid

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CAS Number: 2616-64-0

Other Names:

(2S,3S,4S,5R,6R)-6-[({[(2R,3S,4R,5R)-5-(2,4-dioxo-3H-pyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

(UDP-GlcA)1; 2616-64-0; UDP-D-glucuronate; UDP-D-glucuronic acid; UDP-glucuronate; UDP-glucuronic acid; udp-glcua; uridine diphosphate glucuronate; uridine diphosphate glucuronic acid

a-D-Glucopyranuronic acid 1->5'-ester with uridine 5'-(trihydrogen pyrophosphate);a-D-Glucopyranuronic acid ester with uridine 5'-pyrophosphate;alpha-D-Glucopyranuronic acid 1-P'-ester with uridine 5'-(trihydrogen diphosphate);alpha-delta-Glucopyranuronic

C00167; UDP-D-glucuronate; UDP-alpha-D-glucuronate; UDP-glucuronate; UDPglucuronate

CHEBI:46309; CHEBI:13506; CHEBI:9846; CHEBI:13489; CHEBI:22104

Glucopyranuronic acid 1-ester with uridine 5'-pyrophosphate; UDP Glucuronate; UDP Glucuronic acid; UDP-D-Glucuronate; UDP-D-Glucuronic acid; UDP-GlcUA; UDP-Glucuronate; UDP-Glucuronic acid; UDP-alpha-D-Glucuronate; UDP-alpha-delta-Glucuronate; UDP-delta-G

Glucopyranuronic acid 1-ester with uridine 5'-pyrophosphate;UDP Glucuronate;UDP Glucuronic acid;UDP-D-Glucuronate;UDP-D-Glucuronic acid;UDP-GlcUA;UDP-Glucuronate;UDP-Glucuronic acid;UDP-alpha-D-Glucuronate;UDP-alpha-delta-Glucuronate;UDP-delta-Glucuronate

LS-71661; Uridine-5'-diphosphate-glucuronic acid sodium salt; alpha-D-Glucopyranuronic acid, 1-5'-ester with uridine 5'-(trihydrogen diphosphate), sodium salt

UDP-alpha-D-glucuronate(3-)

UDP-alpha-D-glucuronate; UDP-alpha-D-glucuronate trianion

UDP-alpha-D-glucuronic acid

UDP-D-glucuronate; UDP-glucuronate; UDP-L-iduronate; UDPglucuronate; uridine diphosphate glucuronate; uridine diphosphate glucuronic acid

UDP-D-glucuronate; UDP-glucuronate; UDPGA; UDPglucuronate; URIDINE DIPHOSPHATE GLUCURONIC ACID; Udp glucuronic acid; Udp-glucuronic acid; Uridine 5'-diphospho-glucuronic acid; Uridine diphosphoglucuronic acid; Uridinediphosphoglucuronic acid; alpha-D-Gluc

UDP-Glucuronic acid

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -5.08 -8.56 -225.46 6 20 -3 323 577.261 9 ↓

Vendor Notes

Note Type Comments Provided By
UniProt Database Links AGLM_HALVD; ARAE1_ARATH; DHAK_RAT; GAE1_ARATH; GAE2_ARATH; GAE3_ARATH; GAE4_ARATH; GAE5_ARATH; GAE6_ARATH; GUMK_XANCE; GUMK_XANCP; LPSL_RHIME; SQV8_CAEEL; TUAD_BACSU; UBGAT_SCUBA; UD110_HUMAN; UD11_HUMAN; UD11_MOUSE; UD11_RAT; UD12_MOUSE; UD12_RAT; UD13_H ChEBI
UniProt Database Links AGLM_HALVD; GAE1_ARATH; GAE2_ARATH; GAE3_ARATH; GAE4_ARATH; GAE5_ARATH; GAE6_ARATH; GUMK_XANCE; GUMK_XANCP; LPSL_RHIME; TUAD_BACSU; UBGAT_SCUBA; UDG5_ECOLX; UDG8_ECOLX; UDG_ECO11; UDG_ECO57; UDG_ECOL6; UDG_ECOLI; UDG_PSEAE; UDG_RHIME; UDG_RICBR; UDG_RICCN ChEBI
Reactome Database Links REACT_120897; REACT_120923; REACT_120936; REACT_120993; REACT_121320; REACT_22274; REACT_22319; REACT_6815; REACT_6876; REACT_6892; REACT_6956 ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
P2Y14-1-E P2Y Purinoceptor 14 (cluster #1 Of 2), Eukaryotic Eukaryotes 370 0.24 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
P2Y14_HUMAN Q15391 Purinergic Receptor P2Y14, Human 370 0.24 Functional ≤ 10μM

Direct Reactome Annotations (via ChEBI)

Description Species
A tetrasaccharide linker sequence is required for GAG synthesis
Abacavir metabolism
Chondroitin sulfate biosynthesis
Formation of the active cofactor, UDP-glucuronate
Glucuronidation
Heme degradation
HS-GAG biosynthesis
Transport of nucleotide sugars

Reactome Annotations from Targets (via Uniprot)

Description Species
G alpha (i) signalling events
P2Y receptors

Analogs ( Draw Identity 99% 90% 80% 70% )