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Abq2CB7vac
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
guaiane sesquiterpenoid
0 references
biogenic aliphatic hydrocarbon
0 references
mass
204.187800768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
alpha-guaiene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄
0 references
canonical SMILES
C=C(C)C1CC2=C(CCC2C)C(C)CC1
0 references
isomeric SMILES
C=C(C)[C@H]1CC[C@@H](C)C2=C(C1)[C@H](C)CC2
0 references
found in taxon
Dumortiera hirsuta
1 reference
stated in
Sesquiterpene hydrocarbons in the liverwort dumortiera hirsuta
Identifiers
InChI
InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+/m1/s1
0 references
InChIKey
ADIDQIZBYUABQK-UPJWGTAASA-N
0 references
PubChem CID
6429358
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ADIDQIZBYUABQK-UPJWGTAASA-N
UniChem compound ID
48111427
1 reference
stated in
UniChem
UNII
ABQ2CB7VAC
1 reference
matched by identifier from
InChIKey
InChIKey
ADIDQIZBYUABQK-UPJWGTAASA-N
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