CID 506784
(2s,4r)-4-benzyloxy-n-[(1s)-1-formylpropyl]-1-[(2s)-3-methyl-2-(naphthalene-1-carbonylamino)butanoyl]pyrrolidine-2-carboxamide
Structural Information
- Molecular Formula
- C32H37N3O5
- SMILES
- CC[C@@H](C=O)NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@H](C(C)C)NC(=O)C2=CC=CC3=CC=CC=C32)OCC4=CC=CC=C4
- InChI
- InChI=1S/C32H37N3O5/c1-4-24(19-36)33-31(38)28-17-25(40-20-22-11-6-5-7-12-22)18-35(28)32(39)29(21(2)3)34-30(37)27-16-10-14-23-13-8-9-15-26(23)27/h5-16,19,21,24-25,28-29H,4,17-18,20H2,1-3H3,(H,33,38)(H,34,37)/t24-,25+,28-,29-/m0/s1
- InChIKey
- JFHAFGFNLFOHFX-BXCBQBLLSA-N
- Compound name
- (2S,4R)-1-[(2S)-3-methyl-2-(naphthalene-1-carbonylamino)butanoyl]-N-[(2S)-1-oxobutan-2-yl]-4-phenylmethoxypyrrolidine-2-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 544.28058 | 232.7 |
[M+Na]+ | 566.26252 | 230.6 |
[M-H]- | 542.26602 | 239.8 |
[M+NH4]+ | 561.30712 | 236.6 |
[M+K]+ | 582.23646 | 227.7 |
[M+H-H2O]+ | 526.27056 | 221.9 |
[M+HCOO]- | 588.27150 | 246.0 |
[M+CH3COO]- | 602.28715 | 256.4 |
[M+Na-2H]- | 564.24797 | 225.8 |
[M]+ | 543.27275 | 232.6 |
[M]- | 543.27385 | 232.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.