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dihydrozeatin

AlkaPlorer ID: AK003992

Synonym: '', '2-Methyl-4-(1H-purin-6-ylamino)butan-1-ol', '2-methyl-4-(9H-purin-6-ylamino)butan-1-ol', 'N(6)-(4-hydroxyisopentanyl)adenine', 'dihydrozeatin', 'Dihydrozeatin', 'N6-(4-Hydroxyisopentanyl)adenine'

IUPAC Name: (2R)-2-methyl-4-(7H-purin-6-ylamino)butan-1-ol

Structure

SMILES: C[C@@H](CO)CCNC1=C2N=CN=C2NC=N1

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InChI: InChI=1S/C10H15N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h5-7,16H,2-4H2,1H3,(H2,11,12,13,14,15)/t7-/m1/s1

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InChIKey: XXFACTAYGKKOQB-SSDOTTSWSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Brassica napus Brassica Brassicaceae Brassicales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 221.26400000000004

TPSA？: 86.72

MolLogP？: 0.7349000000000001

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT001389 C/C(=C\CNc1ncnc2nc[nH]c12)CO>>C[C@@H](CO)CCNc1ncnc2nc[nH]c12 enzymemap_20184
AKRT012696 C[C@@H](CO)CCNc1ncnc2nc[nH]c12.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1>>C[C@H](CCNc1ncnc2nc[nH]c12)CO[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O enzymemap_35664
AKRT015222 Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)[nH]c1=O.C[C@@H](CO)CCNc1ncnc2nc[nH]c12>>C[C@@H](CO)CCNc1ncnc2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c12 enzymemap_33932