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(Q74417028)
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(-)-10-epi-cubebol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
sesquiterpenoid
0 references
tertiary alcohol
0 references
1-epi-Cubebol
1 reference
based on heuristic
inferred from SMILES
(1S,10S)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
1 reference
based on heuristic
inferred from SMILES
(1R,4S,6R,7S,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
1 reference
based on heuristic
inferred from SMILES
(+)-Cubebol
1 reference
based on heuristic
inferred from SMILES
(3S,3aR,3bR,4S,7R,7aR)-4-Isopropyl-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-ol
1 reference
based on heuristic
inferred from SMILES
Epicubebol
1 reference
based on heuristic
inferred from SMILES
(1R,4S,6R,7S,10S)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
1 reference
based on heuristic
inferred from SMILES
mass
222.198365452
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
cubebol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,4R,5S,6S,7R,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
4-epi-cubebol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,4R,5R,6R,7S,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,4S,5S,6R,7S,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₆O
0 references
canonical SMILES
OC1(C)CCC23C(C)CCC(C(C)C)C3C12
0 references
isomeric SMILES
C[C@H]1CC[C@H]([C@H]2[C@]13[C@@H]2[C@@](CC3)(C)O)C(C)C
0 references
found in taxon
Chamaecyparis obtusa
1 reference
stated in
Sesquiterpene alcohols from Chamaecyparis obtusa leaf oil
Iphiona scabra
1 reference
stated in
10-EPI-cubebolxyloside from Iphiona scabra
Identifiers
InChI
InChI=1S/C15H26O/c1-9(2)11-6-5-10(3)15-8-7-14(4,16)13(15)12(11)15/h9-13,16H,5-8H2,1-4H3/t10-,11-,12+,13-,14-,15+/m0/s1
0 references
InChIKey
KONGRWVLXLWGDV-RODWMJHOSA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
46187190
1 reference
matched by identifier from
InChIKey
InChIKey
KONGRWVLXLWGDV-RODWMJHOSA-N
Reaxys registry number
20299511
1 reference
stated in
ChEBI release 2019-11-01
ChEBI ID
138045
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H26O/c1-9(2)11-6-5-10(3)15-8-7-14(4,16)13(15)12(11)15/h9-13,16H,5-8H2,1-4H3/t10-,11-,12+,13-,14-,15+/m0/s1
UniChem compound ID
32475573
1 reference
stated in
UniChem
KNApSAcK ID
C00060398
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KONGRWVLXLWGDV-RODWMJHOSA-N
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