| Properties | Image |
|---|
| MNX_ID | MNXM744646 |
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| reference | biggM:aspalaarg |
| formula | C13H24N6O6 |
| global charge | 0 |
| mol weight | 360.371 |
| InChIKey | UWMIZBCTVWVMFI-XLPZGREQSA-N |
| InChI | InChI=1S/C13H24N6O6/c1-6(18-11(23)7(14)5-9(20)21)10(22)19-8(12(24)25)3-2-4-17-13(15)16/h6-8H,2-5,14H2,1H3,(H,18,23)(H,19,22)(H,20,21)(H,24,25)(H4,15,16,17)/t6-,7+,8+/m0/s1 |
| SMILES | C[C@H](NC(=O)[C@H](N)CC(=O)[O-])C(=O)N[C@H](CCCNC(N)=[NH2+])C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H24N6O6/c1-6(18-11(23)7(14)5-9(20)21)10(22)19-8(12(24)25)3-2-4-17-13(15)16/h6-8H,2-5,14H2,1H3,(H,18,23)(H,19,22)(H,20,21)(H,24,25)(H4,15,16,17)/t6-,7+,8+/m0/s1 |
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| SMILES (mnx) | [CH3:1][C@@H:6]([C:10](=[N:19][C@H:8]([CH2:3][CH2:2][CH2:4][NH:17][C:13](=[NH:15])[NH2:16])[C:12](=[O:24])[OH:25])[OH:22])[N:18]=[C:11]([C@@H:7]([CH2:5][C:9](=[O:20])[OH:21])[NH2:14])[OH:23] |
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