Summary

IMPPAT Phytochemical identifier: IMPHY002543

Phytochemical name: Viscumiside A

Synonymous chemical names:
viscumside a

External chemical identifiers:
CID:14035424

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Chemical structure information

SMILES:
OCC1OC(Oc2cc3OC(CC(=O)c3c(c2)O)c2ccc(c(c2)OC)O)C(C(C1O)O)O

InChI:
InChI=1S/C22H24O11/c1-30-15-4-9(2-3-11(15)24)14-7-13(26)18-12(25)5-10(6-16(18)32-14)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,14,17,19-25,27-29H,7-8H2,1H3

InChIKey:
KZQCCKUDYVSOLC-UHFFFAOYSA-N

DeepSMILES:
OCCOCOcccOCCC=O)c6cc%10)O)))))cccccc6)OC)))O)))))))))))CCC6O))O))O

Functional groups:
CO, cC(C)=O, cO, cOC, cOC(C)OC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC(c2ccccc2)Oc2cc(OC3CCCCO3)ccc21

Scaffold Graph/Node level:
OC1CC(C2CCCCC2)OC2CC(OC3CCCCO3)CCC12

Scaffold Graph level:
CC1CC(C2CCCCC2)CC2CC(CC3CCCCC3)CCC12

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Phenylpropanoids and polyketides

ClassyFire Class: Flavonoids

ClassyFire Subclass: Flavonoid glycosides

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP Classifier Superclass: Flavonoids

NP Classifier Class: Flavanones

NP-Likeness score: 2.09

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Chemical structure download