Structure Database (LMSD)

Common Name
(-)-sabinene
Systematic Name
(1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexane (1S,5S)-thuj-4(10)-ene
Synonyms
  • (1S,5S)-1-isopropyl-4-methylenebicyclo[3.1.0]hexane
LM ID
LMPR0102120035
Formula
Exact Mass
Calculate m/z
136.1252
Status
Active

Classification

String Representations

InChiKey (Click to copy)
NDVASEGYNIMXJL-UWVGGRQHSA-N
InChi (Click to copy)
InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h7,9H,3-6H2,1-2H3/t9-,10-/m0/s1
SMILES (Click to copy)
C1CC([C@]2([H])C[C@]12C(C)C)=C

Other Databases

Wikipedia
HMDB ID
CHEBI ID
PubChem CID
PDB ID

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 2
Aromatic Rings 0
Rotatable Bonds 1
Van der Waals Molecular Volume 154.20
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 3.00
Molar Refractivity 43.75

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Updated at
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