| Properties | Image |
| MNX_ID | MNXM1127691 |
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| reference | chebi:165118 |
| formula | C17H25N3O5 |
| global charge | 0 |
| mol weight | 351.403 |
| InChIKey | GGXUDPQWAWRINY-XEGUGMAKSA-N |
| InChI | InChI=1S/C17H25N3O5/c1-3-10(2)15(17(25)19-9-14(22)23)20-16(24)13(18)8-11-4-6-12(21)7-5-11/h4-7,10,13,15,21H,3,8-9,18H2,1-2H3,(H,19,25)(H,20,24)(H,22,23)/t10-,13-,15-/m0/s1 |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H25N3O5/c1-3-10(2)15(17(25)19-9-14(22)23)20-16(24)13(18)8-11-4-6-12(21)7-5-11/h4-7,10,13,15,21H,3,8-9,18H2,1-2H3,(H,19,25)(H,20,24)(H,22,23)/t10-,13-,15-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][C@H:10]([CH3:2])[C@@H:15]([C:17](=[N:19][CH2:9][C:14](=[O:22])[OH:23])[OH:25])[N:20]=[C:16]([C@H:13]([CH2:8][C:11]1=[CH:5][CH:7]=[C:12]([OH:21])[CH:6]=[CH:4]1)[NH2:18])[OH:24] |
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