Structure Database (LMSD)

Common Name
(+)-delta-Cadinene
Systematic Name
Synonyms
LM ID
LMPR0103330001
Formula
Exact Mass
Calculate m/z
204.1878
Status
Active


Main

Classification

String Representations

InChiKey (Click to copy)
FUCYIEXQVQJBKY-ZFWWWQNUSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13,15H,5-8H2,1-4H3/t13-,15-/m0/s1
SMILES (Click to copy)
[C@@]12([H])C=C(CCC1=C(C)CC[C@H]2C(C)C)C

References

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 2
Aromatic Rings 0
Rotatable Bonds 1
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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Created at
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Updated at
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