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CHEBI:35663 - carane
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ChEBI Ontology
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ChEBI Name
carane
ChEBI ID
CHEBI:35663
Definition
A carbobicyclic compound that is bicyclo[4.1.0]heptane substituted by methyl groups at positions 3, 7 and 7.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C10H18
Net Charge
0
Average Mass
138.24992
Monoisotopic Mass
138.14085
InChI
InChI=1S/C10H18/c1-7-4-5-8-9(6-7)10(8,2)3/h7-9H,4-6H2,1-3H3
InChIKey
BWRHOYDPVJPXMF-UHFFFAOYSA-N
SMILES
CC1CCC2C(C1)C2(C)C
ChEBI Ontology
Outgoing
carane (
CHEBI:35663
)
is a
carbobicyclic compound (
CHEBI:36785
)
carane (
CHEBI:35663
)
is a
monoterpene (
CHEBI:35187
)
carane (
CHEBI:35663
)
is a
terpenoid fundamental parent (
CHEBI:35662
)
Incoming
(−)-car-4-ene (
CHEBI:87676
)
has parent hydride
carane (
CHEBI:35663
)
car-3-ene (
CHEBI:35661
)
has parent hydride
carane (
CHEBI:35663
)
IUPAC Names
3,7,7-trimethylbicyclo[4.1.0]heptane
carane
Manual Xref
Database
LMPR0102120028
LIPID MAPS
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Registry Numbers
Types
Sources
2496763
Reaxys Registry Number
Reaxys
2496763
Beilstein Registry Number
Beilstein
554-59-6
CAS Registry Number
ChemIDplus
554-59-6
CAS Registry Number
NIST Chemistry WebBook
Last Modified
23 October 2015