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UNII-78123715A8
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
copaene
0 references
(1S,2R,6R,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
1 reference
based on heuristic
inferred from SMILES
α-copaene
1 reference
based on heuristic
inferred from SMILES
1,3-Dimethyl-8-(1-methylethyl)-tricyclo[4.4.0.02,7]dec-3-ene
1 reference
based on heuristic
inferred from SMILES
(1R,2S,7S,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
1 reference
based on heuristic
inferred from SMILES
(1S,6R,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
1 reference
based on heuristic
inferred from SMILES
mass
204.187800768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
alpha-ylangene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,2R,6R,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
1 reference
based on heuristic
inferred from InChI
alpha-Ylangene
1 reference
based on heuristic
inferred from InChI
alpha-copaene
1 reference
based on heuristic
inferred from InChI
(1R,2S,6S,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄
0 references
canonical SMILES
C1=C(C)C2C3C(CCC2(C)C3C1)C(C)C
0 references
isomeric SMILES
CC1=CC[C@@H]2[C@@H]3[C@H]1[C@]2(CC[C@@H]3C(C)C)C
0 references
found in taxon
Picea glehnii
1 reference
stated in
Mono- and sesquiterpenoids of the oleoresin ofPicea glehnii
Angelica archangelica
2 references
stated in
Optical isomers of .alpha.-copaene derived from several plant sources
stated in
Additional male mediterranean fruitfly (Ceratitis capitata wied.) Attractants from Angelica seed oil (Angelica archangelica L.).
Dumortiera hirsuta
1 reference
stated in
Sesquiterpene hydrocarbons in the liverwort dumortiera hirsuta
Preissia quadrata
1 reference
stated in
The sesquiterpene constituents of the liverwort Preissia quadrata
Juniperus oxycedrus
1 reference
stated in
On terpenes. CXII. The composition of the oil from Juniperus oxycedrus L. berries
Pinus albicaulis
1 reference
stated in
The Structure of alpha-Longipinene, a Minor Sesquiterpene of the Wood of Pinus silvestris L. and of Swedish Sulphate Turpentine.
Prumnopitys andina
1 reference
stated in
Foliage sesquiterpenes and diterpenes of Podocarpus spicatus
Prumnopitys taxifolia
1 reference
stated in
Foliage sesquiterpenes and diterpenes of Podocarpus spicatus
Marchantia quadrata
1 reference
stated in
The sesquiterpene constituents of the liverwort Preissia quadrata
Identifiers
InChI
InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12-,13-,14+,15+/m1/s1
0 references
InChIKey
VLXDPFLIRFYIME-ZSAUSMIDSA-N
0 references
CAS Registry Number
947-59-1
0 references
PubChem CID
636457
1 reference
matched by identifier from
InChIKey
InChIKey
VLXDPFLIRFYIME-ZSAUSMIDSA-N
UniChem compound ID
48185150
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20348370
1 reference
matched by identifier from
InChIKey
InChIKey
VLXDPFLIRFYIME-ZSAUSMIDSA-N
DSSTOX compound identifier
DTXCID50299442
0 references
UNII
78123715A8
1 reference
matched by identifier from
InChIKey
InChIKey
VLXDPFLIRFYIME-ZSAUSMIDSA-N
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