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English
(+/-)-Praeruptorin A
group of stereoisomers with the chemical formula C₂₁H₂₂O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
386.136553044
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₂O₇
0 references
canonical SMILES
O=C1OC2=C(C=C1)C=CC=3OC(C)(C)C(OC(=O)C(=CC)C)C(OC(=O)C)C32
0 references
found in taxon
Angelica decursiva
1 reference
stated in
Inhibitors of nitric oxide production from the flowers of Angelica furcijuga: structures of hyuganosides IV and V.
Seseli bocconi
1 reference
stated in
Coumarins from Seseli bocconi
Identifiers
InChI
InChI=1S/C21H22O7/c1-6-11(2)20(24)27-19-18(25-12(3)22)16-14(28-21(19,4)5)9-7-13-8-10-15(23)26-17(13)16/h6-10,18-19H,1-5H3
0 references
InChIKey
XGPBRZDOJDLKOT-UHFFFAOYSA-N
0 references
PubChem CID
73189387
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XGPBRZDOJDLKOT-UHFFFAOYSA-N
UniChem compound ID
70510400
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0242259
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XGPBRZDOJDLKOT-UHFFFAOYSA-N
Probes And Drugs ID
PD065098
0 references
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