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(Q105370872)
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English
phellodensin D
group of stereoisomers with the chemical formula C₂₀H₂₀O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
8C-substituted flavanone
1 reference
inferred from
8C-substituted flavanone
flavanone
0 references
mass
356.12598836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₀O₆
0 references
canonical SMILES
O=C1C2=C(O)C=C3OC(CC3=C2OC(C4=CC=C(O)C=C4)C1)C(O)(C)C
0 references
isomeric SMILES
CC(C)(O)C1Cc2c(cc(O)c3c2O[C@H](c2ccc(O)cc2)CC3=O)O1
0 references
found in taxon
Phellodendron chinense
1 reference
stated in
Constituents of Leaves of Phellodendron Chinense var. glabriusculum.
Identifiers
InChI
InChI=1S/C20H20O6/c1-20(2,24)17-7-12-16(25-17)9-14(23)18-13(22)8-15(26-19(12)18)10-3-5-11(21)6-4-10/h3-6,9,15,17,21,23-24H,7-8H2,1-2H3/t15-,17?/m0/s1
0 references
InChIKey
ZBVQSGGQLPHKKZ-MYJWUSKBSA-N
0 references
PubChem CID
5316782
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZBVQSGGQLPHKKZ-MYJWUSKBSA-N
ChEBI ID
197109
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H20O6/c1-20(2,24)17-7-12-16(25-17)9-14(23)18-13(22)8-15(26-19(12)18)10-3-5-11(21)6-4-10/h3-6,9,15,17,21,23-24H,7-8H2,1-2H3/t15-,17?/m0/s1
UniChem compound ID
33966042
1 reference
stated in
UniChem
LIPID MAPS ID
LMPK12140268
1 reference
InChIKey
ZBVQSGGQLPHKKZ-MYJWUSKBSA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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