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Zeatin - Substance Summary (SID 3661)

An aminopurine factor in plant extracts that induces cell division. (Grant & Hackh's Chemical Dict, 5th ed)


Drug and Chemical Information: (Total:1)         

Pharmacological Action

Plant Growth Regulators - Any of the hormones produced naturally in plants and active in controlling growth and other functions. There are three primary classes: auxins, cytokinins, and gibberellins.


  Pharmacological Classification
Chemical Actions and Uses
      Pharmacologic Actions
            Physiological Effects of Drugs
                  Growth Substances
                        Plant Growth Regulators


  Chemical Classification
Heterocyclic Compounds
      Heterocyclic Compounds, 2-Ring
            Purines
                  Adenine
                        Cytokinins
                              Zeatin


Safety and Toxicology

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Data Source:   

Depositor: KEGG
External ID: C00371

Depositor-Supplied Synonyms: (Total: 6)
Sort:
Zeatin
trans-Zeatin
N6-(4-Hydroxyisopentenyl)adenine
C00371
(E)-2-Methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol
1637-39-4


Properties Computed from Structure:
Molecular Weight219.24312 [g/mol]
Molecular FormulaC10H13N5O
XLogP3-AA0.7
H-Bond Donor3
H-Bond Acceptor6
Rotatable Bond Count4
Tautomer Count8
Exact Mass219.11201
MonoIsotopic Mass219.11201
Topological Polar Surface Area86.7
Heavy Atom Count16
Formal Charge0
Complexity258
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count1
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1


Descriptors Computed from Structure:
IUPAC Name: (E)-2-methyl-4-(7H-purin-6-ylamino)but-2-en-1-ol
Canonical SMILES: CC(=CCNC1=NC=NC2=C1NC=N2)CO
Isomeric SMILES: C/C(=C\CNC1=NC=NC2=C1NC=N2)/CO
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-FARCUNLSSA-N


Substance Information:
SID 3661   
Deposit Date: 2005-06-24
Modify Date: 2008-09-10

CID 449093   
Create Date: 2004-09-16

Related Substances:
Same: 30 Links
Same, Connectivity: 46 Links
Same, Stereochemistry: 32 Links
Same, Isotopes: 44 Links

Similar Substances: 207 Links


Depositor-Supplied Comments:
CAS: 1637-39-4
ChEBI: 16522
KNApSAcK: C00000091
3DMET: B01232
Is a reactant or product of enzyme EC 1.3.1.69
Is a reactant or product of enzyme EC 2.4.1.203
Is a reactant or product of enzyme EC 2.4.1.-
Is a reactant or product of enzyme EC 2.4.2.40
Is a reactant or product of enzyme EC 2.5.1.50

     
Compound Displayed

2D

3D

Compound ID449093
Molecular Weight219.24312 [g/mol]
Molecular FormulaC10H13N5O
XLogP3-AA0.7
H-Bond Donor3
H-Bond Acceptor6


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