CHEBI:128754 - GDP-valienol

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ChEBI Name GDP-valienol
ChEBI ID CHEBI:128754
Definition A nucleotide conjugate consisting of CDP joined at the 1-position of valienol via a diphosphate linkage.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB22657057, ChemicalBook:CB12566507, eMolecules:26937692, ZINC000013514412
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Formula C17H25N5O15P2
Net Charge 0
Average Mass 601.353
Monoisotopic Mass 601.08224
InChI InChI=1S/C17H25N5O15P2/c18-17-20-14-8(15(29)21-17)19-4-22(14)16-13(28)11(26)7(35-16)3-34-38(30,31)37-39(32,33)36-6-1-5(2-23)9(24)12(27)10(6)25/h1,4,6-7,9-13,16,23-28H,2-3H2,(H,30,31)(H,32,33)(H3,18,20,21,29)/t6-,7+,9+,10-,11+,12-,13+,16+/m0/s1
InChIKey SBXHHXUHVHYPDE-WPOGMVEHSA-N
SMILES [C@@H]1([C@@H]([C@H]([C@H](C=C1CO)OP(OP(=O)(OC[C@@H]2[C@H]([C@H]([C@H](N3C=4N=C(NC(C4N=C3)=O)N)O2)O)O)O)(O)=O)O)O)O
Metabolite of Species Details
Streptomyces hygroscopicus (NCBI:txid1912) See: PubMed
Roles Classification
Biological Role(s): bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing GDP-valienol (CHEBI:128754) has functional parent GDP (CHEBI:17552)
GDP-valienol (CHEBI:128754) has role bacterial xenobiotic metabolite (CHEBI:76976)
GDP-valienol (CHEBI:128754) is a cyclitol phosphate (CHEBI:23450)
GDP-valienol (CHEBI:128754) is a nucleotide conjugate (CHEBI:47784)
GDP-valienol (CHEBI:128754) is conjugate acid of GDP-valienol(2−) (CHEBI:91253)
Incoming GDP-valienol(2−) (CHEBI:91253) is conjugate base of GDP-valienol (CHEBI:128754)
IUPAC Name
5'-O-{hydroxy[(hydroxy{[(1S,4R,5S,6R)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]oxy}phosphoryl)oxy]phosphoryl}guanosine
Manual Xref Database
CPD-18787 MetaCyc
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Registry Number Type Source
21164356 Reaxys Registry Number Reaxys
Citation Type Source
21766819 PubMed citation Europe PMC
Last Modified
18 April 2016