9-ribosyl-trans-zeatin 5'-diphosphate(3-) (CHEBI:87950)

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CHEBI:87950 - 9-ribosyl-trans-zeatin 5'-diphosphate(3−)

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ChEBI ID	CHEBI:87950
ChEBI Name	9-ribosyl-trans-zeatin 5'-diphosphate(3−)
Stars
ASCII Name	9-ribosyl-trans-zeatin 5'-diphosphate(3-)
Definition	A organophosphate oxoanion that is ADP(3−) substituted at position N-6 by a (2E)-4-hydroxy-3-methylbut-2-en-1-yl group; major structure at pH 7.3.
Last Modified	8 October 2015
Submitter	Anne Morgat
Downloads	Molfile

Formula	C15H20N5O11P2
Net Charge	-3
Average Mass	508.297
Monoisotopic Mass	508.06510
SMILES	C/C(=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O)CO
InChI	InChI=1S/C15H23N5O11P2/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(23)11(22)9(30-15)5-29-33(27,28)31-32(24,25)26/h2,6-7,9,11-12,15,21-23H,3-5H2,1H3,(H,27,28)(H,16,17,18)(H2,24,25,26)/p-3/b8-2+/t9-,11-,12-,15-/m1/s1
InChIKey	MXFPFNSSZYNJGX-HNNGNKQASA-K

ChEBI Ontology

Outgoing Relation(s)
	9-ribosyl-trans-zeatin 5'-diphosphate(3−) (CHEBI:87950) has functional parent ADP(3−) (CHEBI:456216)
	9-ribosyl-trans-zeatin 5'-diphosphate(3−) (CHEBI:87950) is a organophosphate oxoanion (CHEBI:58945)
	9-ribosyl-trans-zeatin 5'-diphosphate(3−) (CHEBI:87950) is conjugate base of 9-ribosyl-trans-zeatin 5'-diphosphate (CHEBI:71875)
Incoming Relation(s)
	9-ribosyl-trans-zeatin 5'-diphosphate (CHEBI:71875) is conjugate acid of 9-ribosyl-trans-zeatin 5'-diphosphate(3−) (CHEBI:87950)

IUPAC Name
N-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-5'-O-[(phosphonatooxy)phosphinato]adenosine

UniProt Name	Source
9-ribosyl-trans-zeatin 5'-diphosphate	UniProt

Manual Xrefs	Databases
CPD-4204	MetaCyc

Citations