Summary

Molecular formula: C27H31NO4
SMILES: COc1cc2CN(C(=O)c2c(c1C/C=C(/CC(=O)C=C(C)C)C)O)CCc1ccccc1
InChI: InChI=1S/C27H31NO4/c1-18(2)14-22(29)15-19(3)10-11-23-24(32-4)16-21-17-28(27(31)25(21)26(23)30)13-12-20-8-6-5-7-9-20/h5-10,14,16,30H,11-13,15,17H2,1-4H3/b19-10+
InChIKey: ZJTHOPGQZOXEJX-VXLYETTFSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1c2ccccc2CN1CCc1ccccc1

Scaffold Graph/Node level:
OC1C2CCCCC2CN1CCC1CCCCC1

Scaffold Graph level:
CC1C(CCC2CCCCC2)CC2CCCCC21

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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:
hericenone b

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External chemical identifiers:
CID_14482559; CAS_1416052-89-5; NPATLAS_NPA011213; CHEMSPIDER_30777163; ZINC_ZINC000103556350

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Chemical structure download