Chemical Components in the PDB

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BPT : Summary

Code

BPT

One-letter code

X

Molecule name

BIS(TRANS-PLATINUM ETHYLENEDIAMINE DIAMINE CHLORO)COMPLEX

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 chloranyl-[4-[(chloranyl-bis($l^{4}-azanyl)platinio)-$l^{4}-azanyl]butyl-$l^{4}-azanyl]-bis($l^{4}-azanyl)platinum

Formula

C4 H24 Cl2 N6 Pt2

Formal charge

0

Molecular weight

617.336 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 N.N.N.N.NCCCCN.Cl[Pt].Cl[Pt]
SMILES OpenEye OEToolkits 2.0.7 C(CC[NH2][Pt]([NH3])([NH3])Cl)C[NH2][Pt]([NH3])([NH3])Cl
Canonical SMILES CACTVS 3.385 N.N.N.N.NCCCCN.Cl[Pt].Cl[Pt]
Canonical SMILES OpenEye OEToolkits 2.0.7 C(CC[NH2][Pt]([NH3])([NH3])Cl)C[NH2][Pt]([NH3])([NH3])Cl

IUPAC InChI

InChI=1S/C4H12N2.2ClH.4H3N.2Pt/c5-3-1-2-4-6;;;;;;;;/h1-6H2;2*1H;4*1H3;;/q;;;;;;;2*+1/p-2

IUPAC InChI key

IVVNZXXPAYQGSH-UHFFFAOYSA-L
BPT

wwPDB Information

Atom count

38 (14 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

2023-09-23

Status

Released

Obsoleted

Not Assigned