| Properties | Image |
|---|
| MNX_ID | MNXM744653 |
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| reference | biggM:asplysglu |
| formula | C15H25N4O8 |
| global charge | -1 |
| mol weight | 389.385 |
| InChIKey | VSMYBNPOHYAXSD-KXUCPTDWSA-M |
| InChI | InChI=1S/C15H26N4O8/c16-6-2-1-3-9(18-13(24)8(17)7-12(22)23)14(25)19-10(15(26)27)4-5-11(20)21/h8-10H,1-7,16-17H2,(H,18,24)(H,19,25)(H,20,21)(H,22,23)(H,26,27)/p-1/t8-,9+,10-/m1/s1 |
| SMILES | N[C@H](CC(=O)[O-])C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@H](CCC(=O)[O-])C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H26N4O8/c16-6-2-1-3-9(18-13(24)8(17)7-12(22)23)14(25)19-10(15(26)27)4-5-11(20)21/h8-10H,1-7,16-17H2,(H,18,24)(H,19,25)(H,20,21)(H,22,23)(H,26,27)/t8-,9+,10-/m1/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:6][NH2:16])[CH2:3][C@@H:9]([C:14](=[N:19][C@H:10]([CH2:4][CH2:5][C:11](=[O:20])[OH:21])[C:15](=[O:26])[OH:27])[OH:25])[N:18]=[C:13]([C@@H:8]([CH2:7][C:12](=[O:22])[OH:23])[NH2:17])[OH:24] |
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