CID 73415788
Myristoyl pentapeptide-4
Structural Information
- Molecular Formula
- C37H71N7O10
- SMILES
- CCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O
- InChI
- InChI=1S/C37H71N7O10/c1-4-5-6-7-8-9-10-11-12-13-14-21-30(48)40-27(19-15-17-22-38)34(50)43-32(26(3)47)36(52)44-31(25(2)46)35(51)41-28(20-16-18-23-39)33(49)42-29(24-45)37(53)54/h25-29,31-32,45-47H,4-24,38-39H2,1-3H3,(H,40,48)(H,41,51)(H,42,49)(H,43,50)(H,44,52)(H,53,54)/t25-,26-,27+,28+,29+,31+,32+/m1/s1
- InChIKey
- XLELDISCQSKJES-IPPMYLEBSA-N
- Compound name
- (2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-6-amino-2-(tetradecanoylamino)hexanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 774.53353 | 269.4 |
[M+Na]+ | 796.51547 | 265.6 |
[M-H]- | 772.51897 | 270.9 |
[M+NH4]+ | 791.56007 | 270.3 |
[M+K]+ | 812.48941 | 263.5 |
[M+H-H2O]+ | 756.52351 | 249.1 |
[M+HCOO]- | 818.52445 | 270.8 |
[M+CH3COO]- | 832.54010 | 306.3 |
[M+Na-2H]- | 794.50092 | 307.3 |
[M]+ | 773.52570 | 298.9 |
[M]- | 773.52680 | 298.9 |
Literature stripe
No literature data available for this compound.