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(Q104951896)
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English
Chabrolol A
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
264.208930136
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,2E,4R,7Z,11E)-1,7,11-trimethylcyclotetradeca-2,7,11-triene-1,4-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₈O₂
0 references
canonical SMILES
OC1C=CC(O)(C)CCC=C(C)CCC=C(C)CC1
0 references
isomeric SMILES
C/C1=C/CC[C@@](C)(O)/C=C\[C@H](O)CC/C(C)=C\CC1
0 references
found in taxon
Litophyton chabrolii
1 reference
stated in
Chabrolols A, B and C, three new norditerpenes from the soft coral Nephthea chabroli
Identifiers
InChI
InChI=1S/C17H28O2/c1-14-6-4-7-15(2)9-10-16(18)11-13-17(3,19)12-5-8-14/h7-8,11,13,16,18-19H,4-6,9-10,12H2,1-3H3/b13-11-,14-8-,15-7-/t16-,17-/m1/s1
0 references
InChIKey
CATGWFPDGYPNRJ-UGTKUNSJSA-N
0 references
PubChem CID
101106323
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CATGWFPDGYPNRJ-UGTKUNSJSA-N
UniChem compound ID
97710267
1 reference
stated in
UniChem
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