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- ChemComp-6ZB: N-hydroxy-L-tryptophanamide -

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Basic information

EntryDatabase: PDB chemical components / ID: 6ZB
NameName: N-hydroxy-L-tryptophanamide / Synonyms: N-hydroxy-L-tryptophanamide

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Chemical information

Composition
Formula: C11H13N3O2 / Number of atoms: 29 / Formula weight: 219.24 / Formal charge: 0
Others

5l03

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 6ZB / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5L03
History
Create componentJul 28, 2016
Initial releaseNov 8, 2017
Modify synonymsMar 1, 2021
External linksUniChem / ChemSpider / BindingDB / Brenda / ChEMBL / Nikkaji / PubChem / SureChEMBL / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 12.01O=C(NO)C(N)Cc2c1ccccc1nc2
CACTVS 3.385N[CH](Cc1c[nH]c2ccccc12)C(=O)NO
OpenEye OEToolkits 2.0.5c1ccc2c(c1)c(c[nH]2)CC(C(=O)NO)N

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SMILES CANONICAL

CACTVS 3.385N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NO
OpenEye OEToolkits 2.0.5c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)NO)N

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InChI

InChI 1.03InChI=1S/C11H13N3O2/c12-9(11(15)14-16)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13,16H,5,12H2,(H,14,15)/t9-/m0/s1

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InChIKey

InChI 1.03LBMAEBPZXXNKMZ-VIFPVBQESA-N

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SYSTEMATIC NAME

ACDLabs 12.01N-hydroxy-L-tryptophanamide
OpenEye OEToolkits 2.0.5(2~{S})-2-azanyl-3-(1~{H}-indol-3-yl)-~{N}-oxidanyl-propanamide

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PDB entries

Showing all 1 items

PDB-5l03:
Crystal structure of 2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE Synthase from BURKHOLDERIA PSEUDOMALLEI bound to L-tryptophan hydroxamate

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