4-amino-4-deoxychorismate

Chemical Formula:

C₁₀H₁₀NO₅

Molecular Weight:

224.193 Daltons

Monoisotopic Mass:

226.0715475009 Daltons

SMILES:

C=C(C(=O)[O-])OC1(C([N+])C=CC(C([O-])=O)=C1)

InChI:

1S/C10H11NO5/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/p-1/t7-,8-/m1/s1

InChIKey:

OIUJHGOLFKDBSU-HTQZYQBOSA-M

Databases

MetaCyc: 4-AMINO-4-DEOXYCHORISMATE

BiGG: 4adcho

PubChem (CID): 45266632

ChEBI: 58406

KEGG: C11355

CAS: 97279-79-3

Seed: cpd08210

MetaNetX: MNXM1458