Summary

Molecular formula: C17H12N2O4
SMILES: OCc1ccc(o1)c1nc(cc2c1[nH]c1c2cccc1)C(=O)O
InChI: InChI=1S/C17H12N2O4/c20-8-9-5-6-14(23-9)16-15-11(7-13(19-16)17(21)22)10-3-1-2-4-12(10)18-15/h1-7,18,20H,8H2,(H,21,22)
InChIKey: USBWYUYKHHILLZ-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1coc(-c2nccc3c2[nH]c2ccccc23)c1

Scaffold Graph/Node level:
C1CCC2C(C1)NC1C2CCNC1C1CCCO1

Scaffold Graph level:
C1CCC2C(C1)CC1C(C3CCCC3)CCCC21

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Chemical classification

Kingdom: Organic compounds
Super class: Alkaloids and derivatives
Class: Harmala alkaloids

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Synonymous chemical names:
flazin

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External chemical identifiers:
CID_5377686; CAS_100041-05-2; CHEMSPIDER_4526683

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Chemical structure download