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(Q105210984)
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English
(ent-7alpha)-7-Hydroxy-8(14),15-pimaradien-19-oic acid
group of stereoisomers with the chemical formula C₂₀H₃₀O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
pimarane diterpenoid
1 reference
inferred from
pimarane diterpenoid
mass
318.21949482
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₀O₃
0 references
canonical SMILES
O=C(O)C1(C)CCCC2(C)C3C(=CC(C=C)(C)CC3)C(O)CC12
0 references
found in taxon
Platycladus orientalis
1 reference
stated in
Diterpenoids from the pericarp of Platycladus orientalis.
Salvia wiedemannii
1 reference
stated in
Diterpenoids from Salvia wiedemannii
Identifiers
InChI
InChI=1S/C20H30O3/c1-5-18(2)10-7-14-13(12-18)15(21)11-16-19(14,3)8-6-9-20(16,4)17(22)23/h5,12,14-16,21H,1,6-11H2,2-4H3,(H,22,23)
0 references
InChIKey
PLKOJNUQWAKPNC-UHFFFAOYSA-N
0 references
PubChem CID
14864259
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
PLKOJNUQWAKPNC-UHFFFAOYSA-N
ChEBI ID
181099
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H30O3/c1-5-18(2)10-7-14-13(12-18)15(21)11-16-19(14,3)8-6-9-20(16,4)17(22)23/h5,12,14-16,21H,1,6-11H2,2-4H3,(H,22,23)
UniChem compound ID
22967295
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0035116
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PLKOJNUQWAKPNC-UHFFFAOYSA-N
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