Summary

Molecular formula: C19H22O5
SMILES: COc1cc2C(=O)OCc2c2c1CCC(O2)(C)CC(=O)C=C(C)C
InChI: InChI=1S/C19H22O5/c1-11(2)7-12(20)9-19(3)6-5-13-16(22-4)8-14-15(17(13)24-19)10-23-18(14)21/h7-8H,5-6,9-10H2,1-4H3
InChIKey: VVVQVJCSSXMDGD-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1OCc2c1ccc1c2OCCC1

Scaffold Graph/Node level:
OC1OCC2C1CCC1CCCOC12

Scaffold Graph level:
CC1CCC2C1CCC1CCCCC12

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Isocoumarans
Sub class: Isobenzofuranones

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Synonymous chemical names:
hericenone i

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Chemical structure download