Summary

Molecular formula: C20H25NO7
SMILES: COC(=O)CC/C(=C/Cc1c(O)cc2c(c1O)CN(C2=O)CCCC(=O)O)/C
InChI: InChI=1S/C20H25NO7/c1-12(6-8-18(25)28-2)5-7-13-16(22)10-14-15(19(13)26)11-21(20(14)27)9-3-4-17(23)24/h5,10,22,26H,3-4,6-9,11H2,1-2H3,(H,23,24)/b12-5+
InChIKey: AHACTOCIJFWNNF-LFYBBSHMSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1NCc2ccccc21

Scaffold Graph/Node level:
OC1NCC2CCCCC21

Scaffold Graph level:
CC1CCC2CCCCC12

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Isoindoles and derivatives
Sub class: Isoindolines

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Synonymous chemical names:
caputmedusin h

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Chemical structure download