Summary

SMILES: OC[C@H]1O[C@@H](Oc2ccc(cc2)C[C@@H](C(=O)O)N)[C@@H]([C@H]([C@@H]1O)O)O
InChI: InChI=1S/C15H21NO8/c16-9(14(21)22)5-7-1-3-8(4-2-7)23-15-13(20)12(19)11(18)10(6-17)24-15/h1-4,9-13,15,17-20H,5-6,16H2,(H,21,22)/t9-,10+,11+,12-,13+,15+/m0/s1
InChIKey: JZAFZYMRELRTKL-MYMCGMNMSA-N
DeepSMILES: OC[C@H]O[C@@H]Occcccc6))C[C@@H]C=O)O))N))))))))[C@@H][C@H][C@@H]6O))O))O
Scaffold Graph/Node/Bond level: c1ccc(OC2CCCCO2)cc1
Scaffold Graph/Node level: C1CCC(OC2CCCCO2)CC1
Scaffold Graph level: C1CCC(CC2CCCCC2)CC1
Functional groups: CC(=O)O; CN; CO; cO[C@@H](C)OC

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Chemical classification

ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Organic acids and derivatives
ClassyFire Class: Carboxylic acids and derivatives
ClassyFire Subclass: Amino acids, peptides, and analogues
NP Classifier Biosynthetic pathway: Amino acids and Peptides
NP Classifier Superclass: Small peptides
NP Classifier Class: Aminoacids

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Synonymous chemical names:
o-(beta-d-glucopyranosyl)-l-tyrosine, tyrosine glucoside

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External chemical identifiers:
CID:193760; ZINC:ZINC000028642631

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Chemical structure download