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(Q104402267)
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English
hoslunddiol
group of stereoisomers with the chemical formula C₂₂H₂₂O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
6C-substituted flavone
1 reference
inferred from
6C-substituted flavone
mass
398.136553044
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₂O₇
0 references
canonical SMILES
O=C1C=C(OC=2C=C(OC)C(=C(O)C12)C3OC(C)C(O)C(O)C3)C=4C=CC=CC4
0 references
isomeric SMILES
COc1cc2oc(-c3ccccc3)cc(=O)c2c(O)c1[C@H]1C[C@@H](O)[C@H](O)C(C)O1
0 references
found in taxon
Hoslundia opposita
1 reference
stated in
Oppositin and 5-O-methylhoslundin, pyrone-substituted flavonoids of Hoslundia opposita
Identifiers
InChI
InChI=1S/C22H22O7/c1-11-21(25)14(24)9-17(28-11)20-16(27-2)10-18-19(22(20)26)13(23)8-15(29-18)12-6-4-3-5-7-12/h3-8,10-11,14,17,21,24-26H,9H2,1-2H3/t11?,14-,17-,21-/m1/s1
0 references
InChIKey
URTJMLCOGKHVDK-OPUDBWHJSA-N
0 references
PubChem CID
44257619
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
ChEBI ID
178235
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H22O7/c1-11-21(25)14(24)9-17(28-11)20-16(27-2)10-18-19(22(20)26)13(23)8-15(29-18)12-6-4-3-5-7-12/h3-8,10-11,14,17,21,24-26H,9H2,1-2H3/t11?,14-,17-,21-/m1/s1
UniChem compound ID
58332858
1 reference
stated in
UniChem
LIPID MAPS ID
LMPK12110140
1 reference
InChIKey
URTJMLCOGKHVDK-OPUDBWHJSA-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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