Structure Database (LMSD)

Common Name
Mutisianthol
Systematic Name
Synonyms
LM ID
LMPR0103360001
Formula
C15H20O
Exact Mass
Calculate m/z
216.151415
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C15 isoprenoids (sesquiterpenes) [PR0103]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Mutisia (#41607)
Magnoliopsida (#3398)
Natural sesquiterpenoids,
Nat Prod Rep, 1999

String Representations

InChiKey (Click to copy)
SVNPNOPENVFTBB-JQWIXIFHSA-N
InChi (Click to copy)
InChI=1S/C15H20O/c1-9(2)5-12-6-10(3)13-8-15(16)11(4)7-14(12)13/h5,7-8,10,12,16H,6H2,1-4H3/t10-,12-/m0/s1
SMILES (Click to copy)
C1(O)C=C2[C@@H](C)C[C@H](/C=C(/C)\C)C2=CC=1C

Other Databases

Wikipedia
Mutisianthol
PubChem CID
10846395

Calculated Physicochemical Properties

Heavy Atoms 16
Rings 2
Aromatic Rings 1
Rotatable Bonds 1
Van der Waals Molecular Volume 230.67
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 4.26
Molar Refractivity 68.05

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Updated at
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