Structure Database (LMSD)
Common Name
(+)-8-hydroxycalamenene
Systematic Name
(5R,8S)-3,8-dimethyl-5-(propan-2-yl)-5,6,7,8-tetrahydronaphthalen-1-ol 7βH-cadina-1,3,5-trien-2-ol
Synonyms
- (+)-8-Hydroxycalamenene
No other lipid differing only in stereochemistry/bond geometry found
3D model of (+)-8-hydroxycalamenene
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)
FDMKIGKOMRSCAW-NWDGAFQWSA-N
InChi (Click to copy)
InChI=1S/C15H22O/c1-9(2)12-6-5-11(4)15-13(12)7-10(3)8-14(15)16/h7-9,11-12,16H,5-6H2,1-4H3/t11-,12+/m0/s1
SMILES (Click to copy)
C1=C(C)C=C2[C@@H](C(C)C)CC[C@H](C)C2=C1O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
2
Aromatic Rings
1
Rotatable Bonds
1
Van der Waals Molecular Volume
233.31
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
4.34
Molar Refractivity
68.07
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Created at
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Updated at
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