Structure Database (LMSD)

Common Name
gamma-himachalene
Systematic Name
3,5,5,9-tetramethyl-2,4a,5,6,7,9a-hexahydro-1H-benzo[7]annulene
Synonyms
LM ID
LMPR0103480007
Formula
C15H24
Exact Mass
Calculate m/z
204.1878
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C15 isoprenoids (sesquiterpenes) [PR0103]
Lippifoliane and himachalane sesquiterpenoids [PR010348]

String Representations

InChiKey (Click to copy)
PUWNTRHCKNHSAT-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h6,10,13-14H,5,7-9H2,1-4H3
SMILES (Click to copy)
C12C(C(C)=CCCC1(C)C)CCC(C)=C2

Other Databases

HMDB ID
HMDB0038168
CHEBI ID
49224
PubChem CID
577062

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 2
Aromatic Rings 0
Rotatable Bonds 0
Van der Waals Molecular Volume 238.06
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 4.73
Molar Refractivity 66.74

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Updated at
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