| Properties | Image |
| MNX_ID | MNXM729754 |
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| reference | sabiorkM:25590 |
| formula | C13H17N3O4 |
| global charge | 0 |
| mol weight | 279.296 |
| InChIKey | KAJAOGBVWCYGHZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C13H17N3O4/c14-7-11(17)15-8-12(18)16-10(13(19)20)6-9-4-2-1-3-5-9/h1-5,10H,6-8,14H2,(H,15,17)(H,16,18)(H,19,20) |
| SMILES | NCC(O)=NCC(O)=NC(CC1=CC=CC=C1)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H17N3O4/c14-7-11(17)15-8-12(18)16-10(13(19)20)6-9-4-2-1-3-5-9/h1-5,10H,6-8,14H2,(H,15,17)(H,16,18)(H,19,20)/t10? |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:9]([CH2:6][CH:10]([C:13](=[O:19])[OH:20])[N:16]=[C:12]([CH2:8][N:15]=[C:11]([CH2:7][NH2:14])[OH:17])[OH:18])[CH:5]=[CH:3]1 |
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