Summary

IMPPAT Phytochemical identifier: IMPHY008757

Phytochemical name: Prosogerin D

Synonymous chemical names:
prosogerin d

External chemical identifiers:
CID:44257587

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Chemical structure information

SMILES:
COc1cc(cc(c1OC)OC)c1cc(=O)c2c(o1)cc(c(c2)OC)O

InChI:
InChI=1S/C19H18O7/c1-22-16-7-11-12(20)8-14(26-15(11)9-13(16)21)10-5-17(23-2)19(25-4)18(6-10)24-3/h5-9,21H,1-4H3

InChIKey:
PCRJTYUZBUQMQK-UHFFFAOYSA-N

DeepSMILES:
COcccccc6OC)))OC))))ccc=O)cco6)cccc6)OC)))O

Functional groups:
c=O, cO, cOC, coc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1cc(-c2ccccc2)oc2ccccc12

Scaffold Graph/Node level:
OC1CC(C2CCCCC2)OC2CCCCC12

Scaffold Graph level:
CC1CC(C2CCCCC2)CC2CCCCC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Phenylpropanoids and polyketides

ClassyFire Class: Flavonoids

ClassyFire Subclass: O-methylated flavonoids

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP Classifier Superclass: Flavonoids

NP Classifier Class: Flavones

NP-Likeness score: 0.828

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Chemical structure download