Structure Database (LMSD)
Common Name
gibberellin A29
Systematic Name
3β,7α-dihydroxy-1β-methyl-8-methylidene-13-oxo-4a,1α-epoxymethano-4aα,4bβ-gibbane-10β-carboxylic acid
Synonyms
- GA29
- Gibberellin A29
3D model of gibberellin A29
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)
BKBYHSYZKIAJDA-WWSAFQOPSA-N
InChi (Click to copy)
InChI=1S/C19H24O6/c1-9-5-17-8-18(9,24)4-3-11(17)19-7-10(20)6-16(2,15(23)25-19)13(19)12(17)14(21)22/h10-13,20,24H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12-,13-,16-,17+,18+,19-/m1/s1
SMILES (Click to copy)
[C@]12(C(O[C@@]3(C[C@H](O)C1)[C@]2([H])[C@H](C(O)=O)[C@@]12CC(=C)[C@@](O)(C1)CC[C@@]32[H])=O)C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
25
Rings
5
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
320.28
Topological Polar Surface Area
106.13
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
logP
2.11
Molar Refractivity
86.80
Admin
Created at
-
Updated at
21st May 2025