Summary

IMPPAT Phytochemical identifier: IMPHY003896

Phytochemical name: cis-Zeatin

Synonymous chemical names:
cis-zeatin

External chemical identifiers:
CID:688597, ChEBI:46570, ZINC:ZINC000013523718, SureChEMBL:SCHEMBL15950878

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Chemical structure information

SMILES:
OC/C(=CCNc1ncnc2c1[nH]cn2)/C

InChI:
InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)/b7-2-

InChIKey:
UZKQTCBAMSWPJD-UQCOIBPSSA-N

DeepSMILES:
OC/C=CCNcncncc6[nH]cn5))))))))))))/C

Functional groups:
C/C=C(C)C, CO, cNC, c[nH]c, cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ncc2[nH]cnc2n1

Scaffold Graph/Node level:
C1NCC2NCNC2N1

Scaffold Graph level:
C1CCC2CCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Imidazopyrimidines

ClassyFire Subclass: Purines and purine derivatives

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Pseudoalkaloids

NP Classifier Class: Purine alkaloids

NP-Likeness score: 0.42

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Chemical structure download