2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion (Q106345529)

chemical compound

2-azaniumyl-4-{5-[(2S)-2-azaniumyl-2-carboxylatoethyl]-1H-imidazol-2-yl}butanoate

Language	Label	Description	Also known as
English	2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion	chemical compound	2-azaniumyl-4-{5-[(2S)-2-azaniumyl-2-carboxylatoethyl]-1H-imidazol-2-yl}butanoate

Statements

instance of

type of chemical entity

0 references

subclass of

2-(3-amino-3-carboxypropyl)-L-histidine

1 reference

based on heuristic

inferred from SMILES

mass

256.117154992 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2-[(3S)-3-amino-3-carboxypropyl]-L-histidine

1 reference

based on heuristic

inferred from InChI

tautomer of

2-(3-amino-3-carboxypropyl)-L-histidine

1 reference

stated in

ChEBI release 2021-03-01

chemical formula

C₁₀H₁₆N₄O₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

NC(CCc1ncc(CC(N)C(=O)O)[nH]1)C(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

NC(CCc1ncc(C[C@H](N)C(=O)O)[nH]1)C(=O)O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C10H16N4O4/c11-6(9(15)16)1-2-8-13-4-5(14-8)3-7(12)10(17)18/h4,6-7H,1-3,11-12H2,(H,13,14)(H,15,16)(H,17,18)/t6?,7-/m0/s1

1 reference

stated in

ChEBI release 2021-03-01

InChIKey

CJCSNWWKPUXVRD-MLWJPKLSSA-N

1 reference

stated in

ChEBI release 2021-03-01

ChEBI ID

58031

mapping relation type

exact match

2 references

stated in

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C10H16N4O4/c11-6(9(15)16)1-2-8-13-4-5(14-8)3-7(12)10(17)18/h4,6-7H,1-3,11-12H2,(H,13,14)(H,15,16)(H,17,18)/t6?,7-/m0/s1

17144

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C10H16N4O4/c11-6(9(15)16)1-2-8-13-4-5(14-8)3-7(12)10(17)18/h4,6-7H,1-3,11-12H2,(H,13,14)(H,15,16)(H,17,18)/t6?,7-/m0/s1

Human Metabolome Database ID

HMDB0011655

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

CJCSNWWKPUXVRD-MLWJPKLSSA-N

2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion (Q106345529)

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2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion (Q106345529)

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Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

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Wikiversity(0 entries)

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Wiktionary(0 entries)

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