CID 42641526
Ethylargininoate acetamidomethionamide
Structural Information
- Molecular Formula
- C15H29N5O4S
- SMILES
- CCOC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCSC)NC(=O)C
- InChI
- InChI=1S/C15H29N5O4S/c1-4-24-14(23)12(6-5-8-18-15(16)17)20-13(22)11(7-9-25-3)19-10(2)21/h11-12H,4-9H2,1-3H3,(H,19,21)(H,20,22)(H4,16,17,18)/t11-,12-/m0/s1
- InChIKey
- XOUOKAFQPWVXEV-RYUDHWBXSA-N
- Compound name
- ethyl (2S)-2-[[(2S)-2-acetamido-4-methylsulfanylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 376.20131 | 192.0 |
[M+Na]+ | 398.18325 | 190.4 |
[M-H]- | 374.18675 | 190.5 |
[M+NH4]+ | 393.22785 | 202.0 |
[M+K]+ | 414.15719 | 190.0 |
[M+H-H2O]+ | 358.19129 | 182.4 |
[M+HCOO]- | 420.19223 | 207.6 |
[M+CH3COO]- | 434.20788 | 232.1 |
[M+Na-2H]- | 396.16870 | 185.6 |
[M]+ | 375.19348 | 192.7 |
[M]- | 375.19458 | 192.7 |
Literature stripe
No literature data available for this compound.