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(Q82873444)
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Junicedric acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(1R,4aS,5R)-5-[(3R)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
Dihydroagathic acid
1 reference
based on heuristic
inferred from SMILES
mass
336.230059504
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,4aR,5R,8aR)-5-[(3S)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,4aR,5S,8aS)-5-[(3S)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
CID 12314310
1 reference
based on heuristic
inferred from InChI
Oliveric Acid
1 reference
based on heuristic
inferred from InChI
(1R,4aR,5S,8aS)-5-[(3R)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-hexahydro-2H-naphthalene-1-carboxylic acid
1 reference
based on heuristic
inferred from InChI
Pinifolic Acid
1 reference
based on heuristic
inferred from InChI
Epipinifolic acid
1 reference
based on heuristic
inferred from InChI
(1S,4aR,5S,8aS)-5-[(3S)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂O₄
0 references
canonical SMILES
O=C(O)CC(C)CCC1C(=C)CCC2C(C(=O)O)(C)CCCC12C
0 references
isomeric SMILES
C[C@@H](CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(C)C(=O)O)C)CC(=O)O
0 references
found in taxon
Pinus merkusii
3 references
stated in
Variability in xylem resin composition amongst natural populations of indonesian Pinus merkusii
stated in
Toxic effects of some conifer resin acids and tea tree oil on human epithelial and fibroblast cells
stated in
Cancer chemopreventive activity of "rosin" constituents of Pinus spez. and their derivatives in two-stage mouse skin carcinogenesis test
Brickellia glomerata
1 reference
stated in
Labdane diterpenes from Brickellia glomerata☆
Cryptomeria japonica
1 reference
stated in
Diterpenoids from leaves of Cryptomeria japonica
Dicranopteris linearis
1 reference
stated in
Terpenoids from TwoDicranopteris Species
Juniperus formosana
1 reference
stated in
Three Labdane-Type Diterpenes from the Bark of Juniperus formosana HAY. var. concolor HAY.
Pinus yunnanensis
1 reference
stated in
Three New Terpenoids fromPinus yunnanensis
Pteris linearis
1 reference
stated in
Terpenoids from TwoDicranopteris Species
Apis mellifera
1 reference
stated in
Terpenes with antimicrobial activity from Cretan propolis
Cupressus sempervirens
1 reference
stated in
Constituents from fruits of Cupressus sempervirens
Identifiers
InChI
InChI=1S/C20H32O4/c1-13(12-17(21)22)6-8-15-14(2)7-9-16-19(15,3)10-5-11-20(16,4)18(23)24/h13,15-16H,2,5-12H2,1,3-4H3,(H,21,22)(H,23,24)/t13-,15-,16+,19+,20-/m0/s1
0 references
InChIKey
HPQKNJHVWUWAOR-BWCMQUJESA-N
0 references
CAS Registry Number
41787-69-3
0 references
PubChem CID
38347252
1 reference
matched by identifier from
InChIKey
InChIKey
HPQKNJHVWUWAOR-BWCMQUJESA-N
UniChem compound ID
53667079
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70904203
1 reference
matched by identifier from
InChIKey
InChIKey
HPQKNJHVWUWAOR-BWCMQUJESA-N
DSSTOX compound identifier
DTXCID701333352
0 references
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