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(Q72502059)
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English
Praeruptorin B
No description defined
Anomalin
[8,8-Dimethyl-9-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] (E)-2-methylbut-2-enoate
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
426.1678531719999
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₂₆O₇
0 references
canonical SMILES
C/C=C(\C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)/C(C)=C/C
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
C/C=C(\C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)/C(C)=C/C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7+,14-8+
0 references
InChIKey
PNTWXEIQXBRCPS-FNCQTZNRSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
81740-07-0
0 references
SureChEMBL ID
SCHEMBL3380751
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PNTWXEIQXBRCPS-FNCQTZNRSA-N
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