(Q2823201)

English

2-amino-3-carboxymuconic semialdehyde

chemical compound

(Z)-2-amino-3-[(Z)-3-oxoprop-1-enyl]but-2-enedioic acid

In more languages

Statements

type of chemical entity

0 references

2-amino-3-carboxymuconic semialdehyde

0 references

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185.032422324 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₇H₇NO₅

2 references

imported from Wikimedia project

English Wikipedia

canonical SMILES

C(=CC(=C(C(=O)O)N)C(=O)O)C=O

1 reference

imported from Wikimedia project

English Wikipedia

isomeric SMILES

C(=C/C(=C(\C(=O)O)/N)/C(=O)O)/C=O

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2 references

Recon 2.2: from reconstruction to model of human metabolism

A community-driven global reconstruction of human metabolism.

Identifiers

InChI=1S/C7H7NO5/c8-5(7(12)13)4(6(10)11)2-1-3-9/h1-3H,8H2,(H,10,11)(H,12,13)/b2-1-,5-4-

1 reference

KACPVQQHDVBVFC-OIFXTYEKSA-N

1 reference

CAS Registry Number

reason for deprecated rank

applies to other chemical entity

intended subject of deprecated statement

2-amino-3-carboxymuconic semialdehyde

1 reference

imported from Wikimedia project

English Wikipedia

1 reference

1 reference

imported from Wikimedia project

English Wikipedia

1 reference

imported from Wikimedia project

English Wikipedia

Reaxys registry number

10167875

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mapping relation type

1 reference

ChEBI release 2021-03-01

UniChem compound ID

1 reference

Human Metabolome Database ID

1 reference

based on heuristic

inferred from InChIKey

1 reference

imported from Wikimedia project

Japanese Wikipedia

Sitelinks

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