Chrysosplenetin

C19H18O8CAS 603-56-5374.35 g/mol

OOOOOHOOHO
EtherPhenol

Properties

Molecular formula
C19H18O8
Molar mass
374.35 g/mol
Exact mass
374.1002 Da
Melting point
203–205 °C
logP
2.91Crippen estimate
Polar surface area
107.6 Ų
H-bond donors / acceptors
2 / 8
Rotatable bonds
5

Identifiers

CAS number
603-56-5
SMILES
COc1cc(-c2oc3cc(OC)c(OC)c(O)c3c(=O)c2OC)ccc1O
InChIKey
NBVTYGIYKCPHQN-UHFFFAOYSA-N
InChI
InChI=1S/C19H18O8/c1-23-11-7-9(5-6-10(11)20)17-19(26-4)16(22)14-12(27-17)8-13(24-2)18(25-3)15(14)21/h5-8,20-21H,1-4H3

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Names and synonyms

12 names
  • 4H-1-Benzopyran-4-one, 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6,7-trimethoxy-
  • Flavone, 4′,5-dihydroxy-3,3′,6,7-tetramethoxy-
  • 5-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one
  • Chrysosplenol B
  • 5,4′-Dihydroxy-3,6,7,3′-tetramethoxyflavone
  • Quercetagetin 3,6,7,3′-tetramethyl ether
  • 3,6,7,3′-Tetra-O-methylquercetagetin
  • EMD 20940
  • 4′,5-Dihydroxy-3,3′,6,7-tetramethoxyflavone
  • Polycladin
  • Jaceidin 7-O-methyl ether
  • Chrysosptertin B

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Elsewhere