chempirical

Palmitoyl tetrapeptide-10

C41H72N6O7CAS 887140-79-6761.06 g/mol

Open in Covalent MOL file
OHNNH2ONHHOONHONHH2NOOH
AlcoholAmideCarboxylic acidPrimary amine

Properties

Molecular formula
C41H72N6O7
Molar mass
761.06 g/mol
Exact mass
760.5462 Da
logP
4.37Crippen estimate
Polar surface area
226.0 Ų
H-bond donors / acceptors
8 / 8
Rotatable bonds
33
Stereocentres
S, S, R, 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
887140-79-6
SMILES
CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCCN)C(=O)O
InChIKey
XCEMXBAGNZCOHW-JPZUFNMASA-N
InChI
InChI=1S/C41H72N6O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-27-36(49)44-33(25-19-21-28-42)38(50)47-37(31(2)48)40(52)46-35(30-32-23-16-15-17-24-32)39(51)45-34(41(53)54)26-20-22-29-43/h15-17,23-24,31,33-35,37,48H,3-14,18-22,25-30,42-43H2,1-2H3,(H,44,49)(H,45,51)(H,46,52)(H,47,50)(H,53,54)/t31-,33+,34+,35+,37+/m1/s1

Weigh it out

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

Work with Palmitoyl tetrapeptide-10

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

Palmitoyl pentapeptide-4214047-00-475 % similar Palmitoyl lysyldioxymethionyllysine1447824-23-858 % similar Pal-tripeptide-1147732-56-754 % similar Somatostatin38916-34-650 % similar Somatostatin51110-01-150 % similar Nociceptin170713-75-449 % similar Tb500885340-08-947 % similar Subtilisin9014-01-147 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook