| Properties | Image |
| MNX_ID | MNXM1128155 |
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| reference | chebi:166194 |
| formula | C13H26N6O4 |
| global charge | 0 |
| mol weight | 330.389 |
| InChIKey | JTWIMNMUYLQNPI-WPRPVWTQSA-N |
| InChI | InChI=1S/C13H26N6O4/c1-7(2)10(14)11(21)18-6-9(20)19-8(12(22)23)4-3-5-17-13(15)16/h7-8,10H,3-6,14H2,1-2H3,(H,18,21)(H,19,20)(H,22,23)(H4,15,16,17)/t8-,10-/m0/s1 |
| SMILES | CC(C)[C@H](N)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H26N6O4/c1-7(2)10(14)11(21)18-6-9(20)19-8(12(22)23)4-3-5-17-13(15)16/h7-8,10H,3-6,14H2,1-2H3,(H,18,21)(H,19,20)(H,22,23)(H4,15,16,17)/t8-,10-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[C@@H:10]([C:11](=[N:18][CH2:6][C:9](=[N:19][C@@H:8]([CH2:4][CH2:3][CH2:5][NH:17][C:13](=[NH:15])[NH2:16])[C:12](=[O:22])[OH:23])[OH:20])[OH:21])[NH2:14] |
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