| Properties | Image |
|---|
| MNX_ID | MNXM1122166 |
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| reference | chebi:159556 |
| formula | C14H26N8O6 |
| global charge | 0 |
| mol weight | 402.412 |
| InChIKey | HAJWYALLJIATCX-FXQIFTODSA-N |
| InChI | InChI=1S/C14H26N8O6/c15-6(4-9(16)23)11(25)22-8(5-10(17)24)12(26)21-7(13(27)28)2-1-3-20-14(18)19/h6-8H,1-5,15H2,(H2,16,23)(H2,17,24)(H,21,26)(H,22,25)(H,27,28)(H4,18,19,20)/t6-,7-,8-/m0/s1 |
| SMILES | NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H26N8O6/c15-6(4-9(16)23)11(25)22-8(5-10(17)24)12(26)21-7(13(27)28)2-1-3-20-14(18)19/h6-8H,1-5,15H2,(H2,16,23)(H2,17,24)(H,21,26)(H,22,25)(H,27,28)(H4,18,19,20)/t6-,7-,8-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][C@@H:7]([C:13](=[O:27])[OH:28])[N:21]=[C:12]([C@H:8]([CH2:5][C:10](=[NH:17])[OH:24])[N:22]=[C:11]([C@H:6]([CH2:4][C:9](=[NH:16])[OH:23])[NH2:15])[OH:25])[OH:26])[CH2:3][NH:20][C:14](=[NH:18])[NH2:19] |
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