The Biofilms Structural Database

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7NU

5MIH

Code

7NU

Name

Phenyl 6,7-dideoxy-6,7-epoxy-beta-D-galacto-heptopyranoside(6D)

Molecular Weight

268.26

Isomeric SMILES

O[[email protected]]1[[email protected]](Oc2ccccc2)O[[email protected]]([[email protected]]2CO2)[[email protected]](O)[[email protected]@H]1O

Formula

C13H16O6

Identifiers

(2~{S},3~{R},4~{S},5~{R},6~{S})-2-[(2~{R})-oxiran-2-yl]-6-phenoxy-oxane-3,4,5-triol

Formal Charge

0

InChI

InChI=1S/C13H16O6/c14-9-10(15)12(8-6-17-8)19-13(11(9)16)18-7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9+,10-,11-,12-,13-/m1/s1

Atom Count

35

InChIKey

BGULDTQQEDQGRU-LREJFELKSA-N

PDB codes

5MIH

Type

NON-POLYMER

Chiral Atom Count

6

Chiral Atoms

C1, C2, C3, C4, C5, C6

Bond Count

37

Aromatic Bond Count

6

Leaving Atoms

n/a