| Properties | Image |
| MNX_ID | MNXM1126211 |
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| reference | chebi:163625 |
| formula | C13H25N5O5 |
| global charge | 0 |
| mol weight | 331.373 |
| InChIKey | AQLHORCVPGXDJW-IUCAKERBSA-N |
| InChI | InChI=1S/C13H25N5O5/c14-6-2-1-3-9(13(22)23)18-12(21)8(4-5-10(16)19)17-11(20)7-15/h8-9H,1-7,14-15H2,(H2,16,19)(H,17,20)(H,18,21)(H,22,23)/t8-,9-/m0/s1 |
| SMILES | NCCCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H25N5O5/c14-6-2-1-3-9(13(22)23)18-12(21)8(4-5-10(16)19)17-11(20)7-15/h8-9H,1-7,14-15H2,(H2,16,19)(H,17,20)(H,18,21)(H,22,23)/t8-,9-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:6][NH2:14])[CH2:3][C@@H:9]([C:13](=[O:22])[OH:23])[N:18]=[C:12]([C@H:8]([CH2:4][CH2:5][C:10](=[NH:16])[OH:19])[N:17]=[C:11]([CH2:7][NH2:15])[OH:20])[OH:21] |
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