| Properties | Image |
| MNX_ID | MNXM1122066 |
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| reference | chebi:159455 |
| formula | C17H34N6O4 |
| global charge | 0 |
| mol weight | 386.497 |
| InChIKey | JWCCFNZJIRZUCL-AVGNSLFASA-N |
| InChI | InChI=1S/C17H34N6O4/c1-9(2)8-12(16(26)27)22-15(25)13(10(3)4)23-14(24)11(18)6-5-7-21-17(19)20/h9-13H,5-8,18H2,1-4H3,(H,22,25)(H,23,24)(H,26,27)(H4,19,20,21)/t11-,12-,13-/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(C)C)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H34N6O4/c1-9(2)8-12(16(26)27)22-15(25)13(10(3)4)23-14(24)11(18)6-5-7-21-17(19)20/h9-13H,5-8,18H2,1-4H3,(H,22,25)(H,23,24)(H,26,27)(H4,19,20,21)/t11-,12-,13-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:9]([CH3:2])[CH2:8][C@@H:12]([C:16](=[O:26])[OH:27])[N:22]=[C:15]([C@H:13]([CH:10]([CH3:3])[CH3:4])[N:23]=[C:14]([C@H:11]([CH2:6][CH2:5][CH2:7][NH:21][C:17](=[NH:19])[NH2:20])[NH2:18])[OH:24])[OH:25] |
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