Structure Database (LMSD)
Common Name
dolichodial
Systematic Name
(1R,2S,5S)-2-(1-formylethenyl)-5-methylcyclopentanecarbaldehyde
Synonyms
- (1R,2S,5S)-2-(1-formylvinyl)-5-methylcyclopentanecarbaldehyde
- Dolichodial
No other lipid differing only in stereochemistry/bond geometry found
3D model of dolichodial
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)
BORBLDJNKYHVJP-FXBDTBDDSA-N
InChi (Click to copy)
InChI=1S/C10H14O2/c1-7-3-4-9(8(2)5-11)10(7)6-12/h5-7,9-10H,2-4H2,1H3/t7-,9+,10+/m0/s1
SMILES (Click to copy)
C1[C@]([C@]([H])(C=O)[C@@H](C)C1)([H])C(=C)C=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
12
Rings
1
Aromatic Rings
0
Rotatable Bonds
3
Van der Waals Molecular Volume
178.86
Topological Polar Surface Area
34.14
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
1.60
Molar Refractivity
46.65
Admin
Created at
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Updated at
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