Chemical Components in the PDB

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G3P : Summary

Code

G3P

One-letter code

X

Molecule name

SN-GLYCEROL-3-PHOSPHATE

Systematic names

ProgramVersionName
ACDLabs 12.01 (2R)-2,3-dihydroxypropyl dihydrogen phosphate
OpenEye OEToolkits 1.7.6 [(2R)-2,3-bis(oxidanyl)propyl] dihydrogen phosphate

Formula

C3 H9 O6 P

Formal charge

0

Molecular weight

172.074 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=P(OCC(O)CO)(O)O
SMILES CACTVS 3.385 OC[CH](O)CO[P](O)(O)=O
SMILES OpenEye OEToolkits 1.7.6 C(C(COP(=O)(O)O)O)O
Canonical SMILES CACTVS 3.385 OC[C@@H](O)CO[P](O)(O)=O
Canonical SMILES OpenEye OEToolkits 1.7.6 C([C@H](COP(=O)(O)O)O)O

IUPAC InChI

InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/t3-/m1/s1

IUPAC InChI key

AWUCVROLDVIAJX-GSVOUGTGSA-N
G3P

wwPDB Information

Atom count

19 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2016-02-24

Status

Released

Obsoleted

Not Assigned