Secondary metabolite: Benzocamphorin E



Benzocamphorin E
Summary
Molecular formula: C18H18O8
SMILES: COc1c(C)c(c2c(C)c(OC)c3c(c2O)OCO3)c(c2c1OCO2)O
InChI: InChI=1S/C18H18O8/c1-7-9(11(19)15-17(13(7)21-3)25-5-23-15)10-8(2)14(22-4)18-16(12(10)20)24-6-26-18/h19-20H,5-6H2,1-4H3
InChIKey: GCHMSLBRCLIDEX-UHFFFAOYSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1cc2c(cc1-c1ccc3c(c1)OCO3)OCO2

Scaffold Graph/Node level:
C1OC2CCC(C3CCC4OCOC4C3)CC2O1

Scaffold Graph level:
C1CC2CCC(C3CCC4CCCC4C3)CC2C1
Chemical classification
Kingdom: Organic compounds
Super class: Phenylpropanoids and polyketides
Class: Tannins
Sub class: Hydrolyzable tannins
Synonymous chemical names:
benzocamphorin e
External chemical identifiers:
CID_89989916; NPATLAS_NPA013245; CHEMSPIDER_78435685; ZINC_ZINC000223076217
Chemical structure download

Designed by R.P. Vivek-Ananth, M Karthikeyan and Ajaya Kumar Sahoo