Chemical Components in the PDB

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RVX : Summary

Code

RVX

One-letter code

S

Molecule name

O-[methyl(2-methylpropoxy)phosphoryl]-L-serine

Systematic names

ProgramVersionName
ACDLabs 12.01 O-[(R)-methyl(2-methylpropoxy)phosphoryl]-L-serine
OpenEye OEToolkits 1.9.2 (2S)-2-azanyl-3-[methyl(2-methylpropoxy)phosphoryl]oxy-propanoic acid

Formula

C8 H18 N O5 P

Formal charge

0

Molecular weight

239.206 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=C(O)C(N)COP(=O)(OCC(C)C)C
SMILES CACTVS 3.385 CC(C)CO[P](C)(=O)OC[CH](N)C(O)=O
SMILES OpenEye OEToolkits 1.9.2 CC(C)COP(=O)(C)OCC(C(=O)O)N
Canonical SMILES CACTVS 3.385 CC(C)CO[P@@](C)(=O)OC[C@H](N)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.9.2 CC(C)CO[P@](=O)(C)OC[C@@H](C(=O)O)N

IUPAC InChI

InChI=1S/C8H18NO5P/c1-6(2)4-13-15(3,12)14-5-7(9)8(10)11/h6-7H,4-5,9H2,1-3H3,(H,10,11)/t7-,15+/m0/s1

IUPAC InChI key

LKLIFUVJCVCJGG-NZFNHWASSA-N
RVX

wwPDB Information

Atom count

33 (15 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

SER

Defined at

2013-02-04

Last modified at

2014-09-05

Status

Released

Obsoleted

Not Assigned