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(Q105309436)
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English
methylcleomiscosin D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-(Hydroxymethyl)-5-methoxy-2-(3,4,5-trimethoxyphenyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one
1 reference
based on heuristic
inferred from SMILES
mass
430.126382284
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₂O₉
0 references
canonical SMILES
O=C1OC=2C=3OC(C4=CC(OC)=C(OC)C(OC)=C4)C(OC3C(OC)=CC2C=C1)CO
0 references
isomeric SMILES
COc1cc([C@@H]2Oc3c(c(OC)cc4ccc(=O)oc34)O[C@H]2CO)cc(OC)c1OC
0 references
found in taxon
Zanthoxylum avicennae
2 references
stated in
Neolignans, a coumarinolignan, lignan derivatives, and a chromene: anti-inflammatory constituents from Zanthoxylum avicennae
stated in
Neolignans, a coumarinolignan, lignan derivatives, and a chromene: anti-inflammatory constituents from Zanthoxylum avicennae
Identifiers
InChI
InChI=1S/C22H22O9/c1-25-13-8-12(9-14(26-2)20(13)28-4)18-16(10-23)29-21-15(27-3)7-11-5-6-17(24)30-19(11)22(21)31-18/h5-9,16,18,23H,10H2,1-4H3/t16-,18-/m0/s1
0 references
InChIKey
WODFFJOYEJBCNO-WMZOPIPTSA-N
0 references
PubChem CID
24800019
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WODFFJOYEJBCNO-WMZOPIPTSA-N
UniChem compound ID
437526
1 reference
stated in
UniChem
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