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O-beta-D-glucosyl-trans-zeatin

AlkaPlorer ID: AK023950

Synonym: 'trans-Zeatin-O-glucoside', 'O-beta-D-Glucosyl-trans-zeatin', 'O-beta-D-glucosyl-trans-zeatin', 'O-beta-D-Glucosylzeatin'

IUPAC Name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(E)-2-methyl-4-(7H-purin-6-ylamino)but-2-enoxy]oxane-3,4,5-triol

Structure

SMILES: C/C(=C\CNC1=C2N=CN=C2NC=N1)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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InChI: InChI=1S/C16H23N5O6/c1-8(2-3-17-14-10-15(19-6-18-10)21-7-20-14)5-26-16-13(25)12(24)11(23)9(4-22)27-16/h2,6-7,9,11-13,16,22-25H,3-5H2,1H3,(H2,17,18,19,20,21)/b8-2+/t9-,11-,12+,13-,16-/m1/s1

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InChIKey: UUPDCCPAOMDMPT-HNVSNYHQSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Cocos nucifera Cocos Arecaceae Arecales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 381.38900000000007

TPSA？: 165.87

MolLogP？: -1.5207999999999993

Number of H-Donors: 6

Number of H-Acceptors: 10

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT001353 C/C(=C\CNc1ncnc2[nH]cnc12)CO.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1>>C/C(=C\CNc1ncnc2[nH]cnc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O R02118
AKRT001385 C/C(=C\CNc1ncnc2nc[nH]c12)CO.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1>>C/C(=C\CNc1ncnc2nc[nH]c12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O enzymemap_35657