The Biofilms Structural Database

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HYI

2FQO

Code

HYI

Name

(2S)-2-amino-4-[(2R,3R)-2,3-dihydroxy-3-N-hydroxycarbamoy-propylmercapto]butyric Acid

Molecular Weight

268.29

Isomeric SMILES

N[C@@H](CCSC[C@H](O)[C@@H](O)C(=O)NO)C(O)=O

Formula

C8H16N2O6S

Identifiers

2S)-2-amino-4-[(2R,3R)-2,3-dihydroxy-4-(hydroxyamino)-4-oxo-butyl]sulfanyl-butanoic acid

Formal Charge

0

InChI

InChI=1S/C8H16N2O6S/c9-4(8(14)15)1-2-17-3-5(11)6(12)7(13)10-16/h4-6,11-12,16H,1-3,9H2,(H,10,13)(H,14,15)/t4-,5-,6+/m0/s1

Atom Count

33

InChIKey

PWFBZASPUNGGAM-HCWXCVPCSA-N

PDB codes

2FQO

Type

Non-polymer

Chiral Atom Count

3

Chiral Atoms

C3, C4, CA

Bond Count

32

Aromatic Bond Count

0

Leaving Atoms

n/a