Summary

Molecular formula: C12H15N3O4
SMILES: O=Cc1ccc(cc1)NNC(=O)CCC(C(=O)O)N
InChI: InChI=1S/C12H15N3O4/c13-10(12(18)19)5-6-11(17)15-14-9-3-1-8(7-16)2-4-9/h1-4,7,10,14H,5-6,13H2,(H,15,17)(H,18,19)
InChIKey: OLPOUQMVOMXOGV-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccccc1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

Kingdom: Organic compounds
Super class: Organic acids and derivatives
Class: Carboxylic acids and derivatives
Sub class: Amino acids, peptides, and analogues

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Synonymous chemical names:
agaritinal

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External chemical identifiers:
CID_10244594; CAS_114847-20-0; CHEMSPIDER_59696894

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Chemical structure download