UCSF

ZINC 12

User Information

Not Authenticated — sign in

Active cart: Temporary Cart (0 items)

Navigation

About
- ZINC
- BCIRC
- Irwin Lab
- Shoichet Lab
- UCSF
- Acknowledgements
- Facts
- Usage
Search
- By:
- Text
- Structure
- Properties
- Catalogs
- ZINC
- Targets
- Rings
- Combination
Subsets
- By:
- Catalog
- Property
- Target
- Ring
- Cart
Help
- Introduction
- FAQ
- Scripting/API
- Quick Search
- Problems
- Filtering
- History
Social
- ZINC Fans
- Decoy Club
- DOCK Fans
- Facebook
- Twitter
- Blog
- Linkedin
Quick Search ZINC ID or SMILES

Synonyms (37)
Vendors (17)
Annotations (22)
Representations (0)
Notes (6)
Targets (6)
Clustered (3)
Reactome (3)
Rings (0)
Analogs (0)

ZINC12405087

12405087

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since	Heavy atoms	Benign functionality
May 13^th, 2008	29	No

Popular Name: Uridine-5'-triphosphoric acid trisodium salt Uridine-5'-triphosphoric acid tr…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 108321-53-5 , 116295-90-0 , 19817-92-6 , 285978-18-9 , 63-39-8 , [19817-92-6] , [285978-18-9]

Other Names:

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

5'-UTP; BRN 0071520; C9H15N2O15P3; EINECS 200-558-7; INS316; INS365 Ophthalmic Solution; LS-160841; UTP; Uridine 5'-(tetrahydrogen triphosphate); Uridine 5'-triphosphate; Uridine 5'-triphosphoric acid; Uridine triphosphate; Uridine, 5'-(tetrahydrogen trip

5'-UTP; BRN 0071520; URIDINE 5'-TRIPHOSPHATE; UTP; Uridine 5'-(tetrahydrogen triphosphate); Uridine 5'-triphosphoric acid; Uridine triphosphate; Uteplex; bmse000295

5'-UTP; H4utp; uridine 5'-triphosphoric acid

5'-UTP; Uridine 5'-triphosphate; Uridine mono(tetrahydrogen triphosphate); Uridine triphosphate; Uridine triphosphic acid; Uteplex; UTP

5'-UTP; UTP; Uridine 5'-triphosphate; Uridine mono(tetrahydrogen triphosphate); Uridine triphosphate; Uteplex

5'-UTP;Uridine 5'-triphosphate;Uridine mono(tetrahydrogen triphosphate);Uridine triphosphate;Uteplex;UTP

5'-UTP;UTP;Uridine 5'-triphosphate;Uridine mono(tetrahydrogen triphosphate);Uridine triphosphate;Uteplex

63-39-8; C00075; UTP; Uridine 5'-triphosphate; Uridine triphosphate

63-39-8; UTP; uridine-5'-triphosphate; uridine-triphosphate

CHEBI:13510; CHEBI:9850; CHEBI:27233

Thiophene sulfonamide

Uridine 5'-triphosphate

Uridine 5'-triphosphate tris salt

Uridine 5'-Triphosphate Trisodium Salt Hydrate

Uridine 5'-triphosphate, trisodium salt, hydrate, 90%

Uridine triphosphate

uridine triphosphate trisodium

URIDINE-13C9, 15N2-5 TRIPHOSPHATE SODI U

URIDINE-13C9,15N2-5TRIPHOSPHATESODIU

Uridine-5'-triphosphate disodium salt

Uridine-5'-triphosphate trisodium salt

Uridine-5'-triphosphate trisodium salt dihydrate

Uridine5'-(tetrahydrogen triphosphate)

UTP (3-); UTP trianion

SMILES:

Annotations

Vendors

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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL

Vendor Notes

Note Type	Comments	Provided By
Mp [°C]	>140	Acros Organics
UniProt Database Links	ACKA_SALTY; ACKA_THEMA; ACTH_THEAC; ACTH_THEVO; AGLF_HALVD; ARC_RHOER; CBACL_PSEUC; CDA_MYROD; CELA_GLUXY; COFE_METJA; DER_THEMA; DGK_BACSU; ENPP1_HUMAN; ENPP1_MOUSE; ENPP1_RAT; ENTP2_HUMAN; ENTP4_HUMAN; ENTP7_HUMAN; ENTP7_MOUSE; ENTP7_PONAB; ENTP7_XENTR	ChEBI
Therapy	psychostimulant	SMDC MicroSource
Reactome Database Links	REACT_1082; REACT_1094; REACT_1138; REACT_1160; REACT_1179; REACT_1374; REACT_1467; REACT_15538; REACT_1611; REACT_1638; REACT_1645; REACT_18287; REACT_18310; REACT_2030; REACT_2053; REACT_209; REACT_21273; REACT_21292; REACT_21305; REACT_21362; REACT_214	ChEBI
S phrase	S24/25: Avoid contact with skin and eyes.	Acros Organics
Patent Database Links	US2007219224; WO2007089703	ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
P2RY2-1-E	Purinergic Receptor P2Y2 (cluster #1 Of 1), Eukaryotic	Eukaryotes	130	0.33	Functional ≤ 10μM
P2RY4-1-E	Pyrimidinergic Receptor P2Y4 (cluster #1 Of 1), Eukaryotic	Eukaryotes	90	0.34	Functional ≤ 10μM
P2RY6-1-E	Pyrimidinergic Receptor P2Y6 (cluster #1 Of 1), Eukaryotic	Eukaryotes	6000	0.25	Functional ≤ 10μM

ChEMBL Target Annotations
Uniprot	Swissprot	Description	Affinity (nM)	LE (kcal/mol/atom)	Type
P2RY2_MOUSE	P35383	P2Y Purinoceptor 2, Mouse	1260	0.28	Functional ≤ 10μM
P2RY2_RAT	P41232	Purinergic Receptor P2Y2, Rat	130	0.33	Functional ≤ 10μM
P2RY2_HUMAN	P41231	Purinergic Receptor P2Y2, Human	100	0.34	Functional ≤ 10μM
P2RY4_HUMAN	P51582	Pyrimidinergic Receptor P2Y4, Human	100	0.34	Functional ≤ 10μM
P2RY4_RAT	O35811	Pyrimidinergic Receptor P2Y4, Rat	2600	0.27	Functional ≤ 10μM
P2RY6_HUMAN	Q15077	Pyrimidinergic Receptor P2Y6, Human	424	0.31	Functional ≤ 10μM

Direct Reactome Annotations (via ChEBI)

Description	Species
DNA replication initiation	Drosophila melanogaster Caenorhabditis elegans Oryza sativa Arabidopsis thaliana Rattus norvegicus Dictyostelium discoideum Plasmodium falciparum Bos taurus Saccharomyces cerevisiae Xenopus tropicalis Danio rerio Mus musculus Schizosaccharomyces pombe Sus scrofa
Formation of the active cofactor, UDP-glucuronate	Saccharomyces cerevisiae Drosophila melanogaster Arabidopsis thaliana Danio rerio Bos taurus Rattus norvegicus Gallus gallus Taeniopygia guttata Caenorhabditis elegans Sus scrofa Canis familiaris Mus musculus Homo sapiens Oryza sativa Dictyostelium discoideum Schizosaccharomyces pombe Xenopus tropicalis
Formation of the Early Elongation Complex	Canis familiaris Drosophila melanogaster Sus scrofa Danio rerio Rattus norvegicus Xenopus tropicalis Bos taurus Gallus gallus Dictyostelium discoideum Mus musculus Taeniopygia guttata
G alpha (i) signalling events	Mus musculus Xenopus tropicalis Danio rerio Bos taurus Canis familiaris Homo sapiens Taeniopygia guttata Sus scrofa Gallus gallus Rattus norvegicus
Glycogen synthesis	Arabidopsis thaliana Schizosaccharomyces pombe Oryza sativa Canis familiaris Drosophila melanogaster Mus musculus Taeniopygia guttata Dictyostelium discoideum Saccharomyces cerevisiae Sus scrofa Xenopus tropicalis Gallus gallus Rattus norvegicus Danio rerio Caenorhabditis elegans Bos taurus Homo sapiens
P2Y receptors	Canis familiaris Homo sapiens Sus scrofa Danio rerio Mus musculus Bos taurus Taeniopygia guttata Xenopus tropicalis Rattus norvegicus Gallus gallus
RNA Polymerase I Chain Elongation	Xenopus tropicalis Danio rerio Rattus norvegicus Gallus gallus Sus scrofa Canis familiaris Taeniopygia guttata Bos taurus Mus musculus
RNA Polymerase II Pre-transcription Events	Sus scrofa Bos taurus Dictyostelium discoideum Rattus norvegicus Taeniopygia guttata Danio rerio Caenorhabditis elegans Mus musculus Drosophila melanogaster Xenopus tropicalis Gallus gallus Canis familiaris
RNA Polymerase II Promoter Escape	Xenopus tropicalis Canis familiaris Arabidopsis thaliana Drosophila melanogaster Sus scrofa Dictyostelium discoideum Mus musculus Saccharomyces cerevisiae Bos taurus Danio rerio Taeniopygia guttata Schizosaccharomyces pombe Gallus gallus Rattus norvegicus Caenorhabditis elegans Oryza sativa
RNA Polymerase II Transcription Elongation	Taeniopygia guttata Dictyostelium discoideum Canis familiaris Rattus norvegicus Bos taurus Drosophila melanogaster Sus scrofa Danio rerio Gallus gallus Mus musculus Xenopus tropicalis Caenorhabditis elegans
RNA Polymerase II Transcription Initiation	Caenorhabditis elegans Dictyostelium discoideum Drosophila melanogaster Taeniopygia guttata Saccharomyces cerevisiae Oryza sativa Schizosaccharomyces pombe Arabidopsis thaliana Bos taurus Canis familiaris Rattus norvegicus Sus scrofa Mus musculus Danio rerio Gallus gallus Xenopus tropicalis
RNA Polymerase III Abortive And Retractive Initiation	Schizosaccharomyces pombe Danio rerio Bos taurus Sus scrofa Taeniopygia guttata Mus musculus Caenorhabditis elegans Gallus gallus Xenopus tropicalis Rattus norvegicus Oryza sativa Drosophila melanogaster Arabidopsis thaliana Dictyostelium discoideum Canis familiaris
RNA Polymerase III Chain Elongation	Schizosaccharomyces pombe Danio rerio Gallus gallus Caenorhabditis elegans Xenopus tropicalis Taeniopygia guttata Sus scrofa Drosophila melanogaster Bos taurus Dictyostelium discoideum Oryza sativa Mus musculus Arabidopsis thaliana Rattus norvegicus Canis familiaris
Synthesis and interconversion of nucleotide di- and triphosphates	Taeniopygia guttata Saccharomyces cerevisiae Xenopus tropicalis Caenorhabditis elegans Homo sapiens Mus musculus Danio rerio Canis familiaris Gallus gallus Sus scrofa Dictyostelium discoideum Oryza sativa Schizosaccharomyces pombe Rattus norvegicus Drosophila melanogaster Bos taurus Plasmodium falciparum Arabidopsis thaliana
Synthesis of UDP-N-acetyl-glucosamine	Homo sapiens Dictyostelium discoideum Rattus norvegicus Gallus gallus Danio rerio Bos taurus Plasmodium falciparum Canis familiaris Taeniopygia guttata Arabidopsis thaliana Saccharomyces cerevisiae Oryza sativa Schizosaccharomyces pombe Xenopus tropicalis Mus musculus Sus scrofa Caenorhabditis elegans Drosophila melanogaster
Telomere C-strand synthesis initiation	Oryza sativa Mus musculus Sus scrofa Danio rerio Plasmodium falciparum Caenorhabditis elegans Xenopus tropicalis Saccharomyces cerevisiae Schizosaccharomyces pombe Rattus norvegicus Dictyostelium discoideum Bos taurus Arabidopsis thaliana Drosophila melanogaster

Reactome Annotations from Targets (via Uniprot)

Description	Species
G alpha (i) signalling events	Homo sapiens (P2RY4_HUMAN) Rattus norvegicus (P2RY4_RAT)
G alpha (q) signalling events	Mus musculus (P2RY2_MOUSE) Homo sapiens (P2RY2_HUMAN)
P2Y receptors	Homo sapiens (P2RY2_HUMAN) Rattus norvegicus (P2RY4_RAT) Mus musculus (P2RY2_MOUSE)

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

No pre-computed analogs available. Try a structural similarity search.

Synonyms (37)
Vendors (17)
Annotations (22)
Representations (0)
Notes (6)
Targets (6)
Clustered (3)
Reactome (3)
Rings (0)
Analogs (0)