(Q82245222)

English

L-Aspartic acid, L-tyrosyl-L-tyrosyl-

chemical compound

In more languages

Statements

type of chemical entity

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chemical compound

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459.16416475999995 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₂H₂₅N₃O₈

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canonical SMILES

NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(=O)O)C(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)N)O

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Identifiers

InChI=1S/C22H25N3O8/c23-16(9-12-1-5-14(26)6-2-12)20(30)24-17(10-13-3-7-15(27)8-4-13)21(31)25-18(22(32)33)11-19(28)29/h1-8,16-18,26-27H,9-11,23H2,(H,24,30)(H,25,31)(H,28,29)(H,32,33)/t16-,17-,18-/m0/s1

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OJCISMMNNUNNJA-BZSNNMDCSA-N

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CAS Registry Number

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1 reference

matched by identifier from

OJCISMMNNUNNJA-BZSNNMDCSA-N

mapping relation type

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ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C22H25N3O8/c23-16(9-12-1-5-14(26)6-2-12)20(30)24-17(10-13-3-7-15(27)8-4-13)21(31)25-18(22(32)33)11-19(28)29/h1-8,16-18,26-27H,9-11,23H2,(H,24,30)(H,25,31)(H,28,29)(H,32,33)/t16-,17-,18-/m0/s1

UniChem compound ID

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DSSTox substance ID

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matched by identifier from

OJCISMMNNUNNJA-BZSNNMDCSA-N

DSSTOX compound identifier

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