Structure Database (LMSD)
Common Name
Gibberellin A3
Systematic Name
Synonyms
3D model of Gibberellin A3
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
IXORZMNAPKEEDV-OBDJNFEBSA-N
InChi (Click to copy)
InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1
SMILES (Click to copy)
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
Cayman ID
PDB ID
Calculated Physicochemical Properties
Heavy Atoms
25
Rings
5
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
317.64
Topological Polar Surface Area
106.13
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
logP
1.89
Molar Refractivity
86.71
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Created at
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Updated at
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