Chemical Components in the PDB

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SYG : Summary

Code

SYG

One-letter code

X

Molecule name

2-[(1~{S})-1-azanylpropyl]phenol

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 2-[(1~{S})-1-azanylpropyl]phenol

Formula

C9 H13 N O

Formal charge

0

Molecular weight

151.206 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CC[CH](N)c1ccccc1O
SMILES OpenEye OEToolkits 2.0.6 CCC(c1ccccc1O)N
Canonical SMILES CACTVS 3.385 CC[C@H](N)c1ccccc1O
Canonical SMILES OpenEye OEToolkits 2.0.6 CC[C@@H](c1ccccc1O)N

IUPAC InChI

InChI=1S/C9H13NO/c1-2-8(10)7-5-3-4-6-9(7)11/h3-6,8,11H,2,10H2,1H3/t8-/m0/s1

IUPAC InChI key

SJYRIEHMQRIBEN-QMMMGPOBSA-N
SYG

wwPDB Information

Atom count

24 (11 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2020-03-13

Last modified at

2020-05-29

Status

Released

Obsoleted

Not Assigned