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(Q104249306)
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English
Cannabicoumaronone
group of stereoisomers with the chemical formula C₂₁H₂₈O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
328.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₈O₃
0 references
canonical SMILES
O=C(C)CCC1C2=COC3=CC(=CC(OC1(C)C)=C32)CCCCC
0 references
found in taxon
Cannabis sativa
1 reference
stated in
Constituents of Cannabis sativa L. XVII. A review of the natural constituents
Identifiers
InChI
InChI=1S/C21H28O3/c1-5-6-7-8-15-11-18-20-16(13-23-18)17(10-9-14(2)22)21(3,4)24-19(20)12-15/h11-13,17H,5-10H2,1-4H3
0 references
InChIKey
CSSYBWPIBDITMG-UHFFFAOYSA-N
0 references
PubChem CID
625303
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
27771515
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID701021177
1 reference
matched by identifier from
InChIKey
InChIKey
CSSYBWPIBDITMG-UHFFFAOYSA-N
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