| Properties | Image |
| MNX_ID | MNXM156408 |
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| reference | chebi:73915 |
| formula | C20H23N3O4 |
| global charge | 0 |
| mol weight | 369.421 |
| InChIKey | FEUPVVCGQLNXNP-IRXDYDNUSA-N |
| InChI | InChI=1S/C20H23N3O4/c21-13-18(24)22-16(11-14-7-3-1-4-8-14)19(25)23-17(20(26)27)12-15-9-5-2-6-10-15/h1-10,16-17H,11-13,21H2,(H,22,24)(H,23,25)(H,26,27)/t16-,17-/m0/s1 |
| SMILES | NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C20H23N3O4/c21-13-18(24)22-16(11-14-7-3-1-4-8-14)19(25)23-17(20(26)27)12-15-9-5-2-6-10-15/h1-10,16-17H,11-13,21H2,(H,22,24)(H,23,25)(H,26,27)/t16-,17-/m0/s1 |
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| SMILES (mnx) | [CH:1]1=[CH:3][CH:7]=[C:14]([CH2:11][C@@H:16]([C:19](=[N:23][C@@H:17]([CH2:12][C:15]2=[CH:9][CH:5]=[CH:2][CH:6]=[CH:10]2)[C:20](=[O:26])[OH:27])[OH:25])[N:22]=[C:18]([CH2:13][NH2:21])[OH:24])[CH:8]=[CH:4]1 |
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