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> Main
CHEBI:48331 - 4,5-(methanoxy-2-methylethano)isolongifol-4-ene
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ChEBI Ontology
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ChEBI Name
4,5-(methanoxy-2-methylethano)isolongifol-4-ene
ChEBI ID
CHEBI:48331
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This entity has been manually annotated by the ChEBI Team.
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Formula
C19H30O
Net Charge
0
Average Mass
274.44090
Monoisotopic Mass
274.22967
InChI
InChI=1S/C19H30O/c1-
12-
10-
20-
11-
13-
8-
17(2,3)
19-
7-
6-
14(9-
19)
18(4,5)
16(19)
15(12)
13/h12,14,16H,6-
11H2,1-
5H3/t12?,14-
,16?,19-
/m0/s1
InChIKey
WORODHPCRUJQIA-UJZFSRJTSA-N
SMILES
CC1COCC2=C1C1C(C)(C)[C@H]3CC[C@@]1(C3)C(C)(C)C2
Roles Classification
Application
(s):
fragrance
A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
4,5-(methanoxy-2-methylethano)isolongifol-4-ene (
CHEBI:48331
)
has role
fragrance (
CHEBI:48318
)
4,5-(methanoxy-2-methylethano)isolongifol-4-ene (
CHEBI:48331
)
is a
isolongifolane sesquiterpenoid (
CHEBI:48418
)
IUPAC Name
(1
S
,12
S
)-
2,2,8,11,11-
pentamethyl-
6-
oxatetracyclo[10.2.1.0
1,10
.0
4,9
]pentadec-
4(9)-
ene
Synonym
Source
2,2,8,11,11-
pentamethyl-
6-
oxatetracyclo[10.2.1.0
1,10
.0
4,9
]pentadec-
4(9)-
ene
Patent
Manual Xref
Database
WO2007030963
Patent
View more database links
Last Modified
01 February 2008