Prezatide copper

C14H23CuN6O4+CAS 89030-95-5402.92 g/mol

NHNOHNNH2OO−HNONH2Cu2+
AmideCarboxylic acidPrimary amine

Properties

Molecular formula
C14H23CuN6O4+
Molar mass
402.92 g/mol
Exact mass
402.1077 Da
logP
-3.24Crippen estimate
Polar surface area
179.1 Ų
H-bond donors / acceptors
5 / 7
Rotatable bonds
11
Stereocentres
S, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
89030-95-5
SMILES
C1=C(NC=N1)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)[O-])NC(=O)CN.[Cu+2]
InChIKey
NZWIFMYRRCMYMN-ACMTZBLWSA-M
InChI
InChI=1S/C14H24N6O4.Cu/c15-4-2-1-3-10(14(23)24)20-13(22)11(19-12(21)6-16)5-9-7-17-8-18-9;/h7-8,10-11H,1-6,15-16H2,(H,17,18)(H,19,21)(H,20,22)(H,23,24);/q;+2/p-1/t10-,11-;/m0./s1

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Names and synonyms

1 names
  • [N2-(N-Glycyl-L-histidyl)-L-lysinato(2-)]copper

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Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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