| Properties | Image |
|---|
| MNX_ID | MNXM744925 |
 |
| reference | biggM:trpalapro |
| formula | C19H24N4O4 |
| global charge | 0 |
| mol weight | 372.425 |
| InChIKey | VZBWRZGNEPBRDE-PJODQICGSA-N |
| InChI | InChI=1S/C19H24N4O4/c1-11(18(25)23-8-4-7-16(23)19(26)27)22-17(24)14(20)9-12-10-21-15-6-3-2-5-13(12)15/h2-3,5-6,10-11,14,16,21H,4,7-9,20H2,1H3,(H,22,24)(H,26,27)/t11-,14-,16-/m0/s1 |
| SMILES | C[C@H](NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2)C(=O)N1CCC[C@H]1C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C19H24N4O4/c1-11(18(25)23-8-4-7-16(23)19(26)27)22-17(24)14(20)9-12-10-21-15-6-3-2-5-13(12)15/h2-3,5-6,10-11,14,16,21H,4,7-9,20H2,1H3,(H,22,24)(H,26,27)/t11-,14-,16-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:11]([C:18]([N:23]1[CH2:8][CH2:4][CH2:7][C@H:16]1[C:19](=[O:26])[OH:27])=[O:25])[N:22]=[C:17]([C@H:14]([CH2:9][C:12]1=[CH:10][NH:21][C:15]2=[CH:6][CH:3]=[CH:2][CH:5]=[C:13]12)[NH2:20])[OH:24] |
|