| Properties | Image |
| MNX_ID | MNXM1121710 |
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| reference | chebi:159099 |
| formula | C18H36N6O4 |
| global charge | 0 |
| mol weight | 400.524 |
| InChIKey | JEXPNDORFYHJTM-IHRRRGAJSA-N |
| InChI | InChI=1S/C18H36N6O4/c1-10(2)8-13(16(26)24-14(17(27)28)9-11(3)4)23-15(25)12(19)6-5-7-22-18(20)21/h10-14H,5-9,19H2,1-4H3,(H,23,25)(H,24,26)(H,27,28)(H4,20,21,22)/t12-,13-,14-/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C18H36N6O4/c1-10(2)8-13(16(26)24-14(17(27)28)9-11(3)4)23-15(25)12(19)6-5-7-22-18(20)21/h10-14H,5-9,19H2,1-4H3,(H,23,25)(H,24,26)(H,27,28)(H4,20,21,22)/t12-,13-,14-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:10]([CH3:2])[CH2:8][C@@H:13]([C:16](=[N:24][C@@H:14]([CH2:9][CH:11]([CH3:3])[CH3:4])[C:17](=[O:27])[OH:28])[OH:26])[N:23]=[C:15]([C@H:12]([CH2:6][CH2:5][CH2:7][NH:22][C:18](=[NH:20])[NH2:21])[NH2:19])[OH:25] |
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