Secondary metabolite: Daldiquinone



Daldiquinone
Summary
Molecular formula: C22H16O5
SMILES: COc1cccc2c1C(=O)C(=O)C=C2c1ccc(c2c1cccc2OC)O
InChI: InChI=1S/C22H16O5/c1-26-18-7-3-5-13-12(9-10-16(23)20(13)18)15-11-17(24)22(25)21-14(15)6-4-8-19(21)27-2/h3-11,23H,1-2H3
InChIKey: QCBKPMIAKLLHHX-UHFFFAOYSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C(c2cccc3ccccc23)c2ccccc2C1=O

Scaffold Graph/Node level:
OC1CC(C2CCCC3CCCCC32)C2CCCCC2C1O

Scaffold Graph level:
CC1CC(C2CCCC3CCCCC32)C2CCCCC2C1C
Chemical classification
Kingdom: Organic compounds
Super class: Benzenoids
Class: Naphthalenes
Sub class: Naphthoquinones
Synonymous chemical names:
daldiquinone
External chemical identifiers:
CID_139589988; NPATLAS_NPA022650; CHEMSPIDER_78435241
Chemical structure download

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