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(Q82938966)
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English
1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,10a-dihydro-4H-benzo[c]chromene-4a-carboxylic acid
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
chemical compound
0 references
mass
358.21440944
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₀O₄
0 references
canonical SMILES
O=C(O)C12OC(C)(C)C3C=CC(=CC3C2=C(O)C=C(CCCCC)C1)C
0 references
found in taxon
Cannabis sativa
2 references
stated in
Secondary metabolism in cannabis
stated in
PKS activities and biosynthesis of cannabinoids and flavonoids in Cannabis sativa L. plants
Identifiers
InChI
InChI=1S/C22H30O4/c1-5-6-7-8-15-12-18(23)19-16-11-14(2)9-10-17(16)21(3,4)26-22(19,13-15)20(24)25/h9-12,16-17,23H,5-8,13H2,1-4H3,(H,24,25)
0 references
InChIKey
YZGCYNMNFASAOK-UHFFFAOYSA-N
0 references
CAS Registry Number
37347-91-4
0 references
PubChem CID
3082459
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YZGCYNMNFASAOK-UHFFFAOYSA-N
UniChem compound ID
44838427
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90958460
1 reference
matched by identifier from
InChIKey
InChIKey
YZGCYNMNFASAOK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID101386365
0 references
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