Summary

IMPPAT Phytochemical identifier: IMPHY005458

Phytochemical name: Norswertianin

Synonymous chemical names:
1,3,7,8-tetrahydroxy-xanthone, 1,3,7,8-tetrahydroxyxanthone, 1,3,7,8-tetrahydroxyxanthones, norswertianin

External chemical identifiers:
CID:5281658, ChEMBL:CHEMBL187043, ChEBI:7637

---

Chemical structure information

SMILES:
Oc1cc(O)c2c(c1)oc1c(c2=O)c(O)c(cc1)O

InChI:
InChI=1S/C13H8O6/c14-5-3-7(16)10-9(4-5)19-8-2-1-6(15)12(17)11(8)13(10)18/h1-4,14-17H

InChIKey:
RVOUOPDWADMVBA-UHFFFAOYSA-N

DeepSMILES:
OcccO)ccc6)occc6=O))cO)ccc6))O

Functional groups:
c=O, cO, coc

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1c2ccccc2oc2ccccc12

Scaffold Graph/Node level:
OC1C2CCCCC2OC2CCCCC21

Scaffold Graph level:
CC1C2CCCCC2CC2CCCCC21

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Benzopyrans

ClassyFire Subclass: 1-benzopyrans

NP Classifier Biosynthetic pathway: Polyketides

NP Classifier Superclass: Xanthones

NP Classifier Class: Methyl xanthones

NP-Likeness score: 1.743

---

Chemical structure download