| Properties | Image |
| MNX_ID | MNXM168265 |
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| reference | sabiorkM:24577 |
| formula | C17H26N4O4 |
| global charge | 0 |
| mol weight | 350.419 |
| InChIKey | MSSJJDVQTFTLIF-UHFFFAOYSA-N |
| InChI | InChI=1S/C17H26N4O4/c18-9-5-4-8-13(19)16(24)21-14(17(25)20-11-15(22)23)10-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,18-19H2,(H,20,25)(H,21,24)(H,22,23) |
| SMILES | NCCCCC(N)C(O)=NC(CC1=CC=CC=C1)C(O)=NCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H26N4O4/c18-9-5-4-8-13(19)16(24)21-14(17(25)20-11-15(22)23)10-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,18-19H2,(H,20,25)(H,21,24)(H,22,23)/t13?,14? |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:6]=[C:12]([CH2:10][CH:14]([C:17](=[N:20][CH2:11][C:15](=[O:22])[OH:23])[OH:25])[N:21]=[C:16]([CH:13]([CH2:8][CH2:4][CH2:5][CH2:9][NH2:18])[NH2:19])[OH:24])[CH:7]=[CH:3]1 |
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