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(Q104948074)
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Trilobinone
group of stereoisomers with the chemical formula C₂₀H₂₈O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
abietane diterpenoid
1 reference
inferred from
abietane diterpenoid
mass
316.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₃
0 references
canonical SMILES
O=C1C(O)C2=CC(=C(O)C=C2C3(C)CCCC(C)(C)C13)C(C)C
0 references
found in taxon
Salvia fruticosa
1 reference
stated in
New Diterpenoids from the Roots of Salvia triloba
Salvia triloba
1 reference
stated in
New Diterpenoids from the Roots of Salvia triloba
Identifiers
InChI
InChI=1S/C20H28O3/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)17(23)16(13)22/h9-11,16,18,21-22H,6-8H2,1-5H3
0 references
InChIKey
BXNFTNLOFARFOZ-UHFFFAOYSA-N
0 references
PubChem CID
131752488
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
BXNFTNLOFARFOZ-UHFFFAOYSA-N
ChEBI ID
189880
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H28O3/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)17(23)16(13)22/h9-11,16,18,21-22H,6-8H2,1-5H3
UniChem compound ID
32005299
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0038885
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BXNFTNLOFARFOZ-UHFFFAOYSA-N
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