Acetyl hexapeptide 38

C₃₀H₅₅N₉O₁₀CAS 1400634-44-7701.82 g/mol

Open in Covalent MOL file

Alcohol Amide Carboxylic acid Guanidine

Properties

Molecular formula: C₃₀H₅₅N₉O₁₀
Molar mass: 701.82 g/mol
Exact mass: 701.4072 Da
logP: -3.61Crippen estimate
Polar surface area: 316.8 Å²
H-bond donors / acceptors: 11 / 10
Rotatable bonds: 21

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

1400634-44-7

SMILES

CC(C)C(C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)NC(CCCN=C(N)N)C(=O)NC(C(C)O)C(=O)O)NC(=O)C(CO)NC(=O)C

InChIKey

BETZBTCJWHBFIG-UHFFFAOYSA-N

InChI

InChI=1S/C30H55N9O10/c1-13(2)20(26(45)35-18(10-9-11-33-30(31)32)24(43)39-23(16(7)41)29(48)49)37-28(47)22(15(5)6)38-27(46)21(14(3)4)36-25(44)19(12-40)34-17(8)42/h13-16,18-23,40-41H,9-12H2,1-8H3,(H,34,42)(H,35,45)(H,36,44)(H,37,47)(H,38,46)(H,39,43)(H,48,49)(H4,31,32,33)

Weigh it out

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

Work with Acetyl hexapeptide 38

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

(S)-2-Acetamido-5-guanidinopentanoic acid dihydrate210545-23-653 % similar Etelcalcetide1262780-97-149 % similar Palmitoyl pentapeptide-4214047-00-446 % similar Tb500885340-08-946 % similar Thymopentin69558-55-045 % similar H-Ser-ile-lys-val-ala-val-oh146439-94-341 % similar N-Acetyl-L-alpha-glutamyl-L-alpha-glutamyl-L-methionyl-L-glutaminyl-L-arginyl-L-arginyl-L-alanyl-L-alpha-asparagine868844-74-041 % similar (2S)-2-[(2S)-2-{[(tert-Butoxy)carbonyl]amino}-3-methylbutanamido]-5-(carbamoylamino)pentanoic acid870487-08-441 % similar

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

Elsewhere

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