Palmitoyl tetrapeptide 3

C₃₄H₆₂N₈O₇CAS 221227-05-0694.92 g/mol

Open in Covalent MOL file

Amide Carboxylic acid Guanidine

Properties

Molecular formula: C₃₄H₆₂N₈O₇
Molar mass: 694.92 g/mol
Exact mass: 694.4741 Da
logP: 1.95Crippen estimate
Polar surface area: 252.4 Å²
H-bond donors / acceptors: 7 / 7
Rotatable bonds: 28
Stereocentres: S, 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

221227-05-0

SMILES

CCCCCCCCCCCCCCCC(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)O

InChIKey

IHRKJQSLKLYWBQ-QKDODKLFSA-N

InChI

InChI=1S/C34H62N8O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-29(44)39-24-30(45)40-25(20-21-28(35)43)32(47)42-23-16-18-27(42)31(46)41-26(33(48)49)17-15-22-38-34(36)37/h25-27H,2-24H2,1H3,(H2,35,43)(H,39,44)(H,40,45)(H,41,46)(H,48,49)(H4,36,37,38)/t25-,26-,27-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

Palmitoyl tetrapeptide-7

Work with Palmitoyl tetrapeptide 3

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Rigin77727-17-474 % similar Alkaline phosphatase9001-78-956 % similar Grgdnp114681-65-155 % similar H-Tyr-gly-arg-lys-lys-arg-arg-gln-arg-arg-arg-oh191936-91-149 % similar Hexapeptide-91228371-11-648 % similar Desmopressin16679-58-648 % similar Dynorphin A (1-13)72957-38-147 % similar Pal-tripeptide-1147732-56-746 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook