| Properties | Image |
| MNX_ID | MNXM1121412 |
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| reference | chebi:158800 |
| formula | C15H29N7O5 |
| global charge | 0 |
| mol weight | 387.441 |
| InChIKey | ITVINTQUZMQWJR-QXEWZRGKSA-N |
| InChI | InChI=1S/C15H29N7O5/c1-7(2)11(14(26)27)22-13(25)9(6-10(17)23)21-12(24)8(16)4-3-5-20-15(18)19/h7-9,11H,3-6,16H2,1-2H3,(H2,17,23)(H,21,24)(H,22,25)(H,26,27)(H4,18,19,20)/t8-,9-,11-/m0/s1 |
| SMILES | CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H29N7O5/c1-7(2)11(14(26)27)22-13(25)9(6-10(17)23)21-12(24)8(16)4-3-5-20-15(18)19/h7-9,11H,3-6,16H2,1-2H3,(H2,17,23)(H,21,24)(H,22,25)(H,26,27)(H4,18,19,20)/t8-,9-,11-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[C@@H:11]([C:14](=[O:26])[OH:27])[N:22]=[C:13]([C@H:9]([CH2:6][C:10](=[NH:17])[OH:23])[N:21]=[C:12]([C@H:8]([CH2:4][CH2:3][CH2:5][NH:20][C:15](=[NH:18])[NH2:19])[NH2:16])[OH:24])[OH:25] |
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