| Properties | Image |
|---|
| MNX_ID | MNXM744848 |
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| reference | biggM:proargasp |
| formula | C15H26N6O6 |
| global charge | 0 |
| mol weight | 386.409 |
| InChIKey | SSSFPISOZOLQNP-CBMCFHRWSA-N |
| InChI | InChI=1S/C15H26N6O6/c16-15(17)19-6-2-4-9(20-12(24)8-3-1-5-18-8)13(25)21-10(14(26)27)7-11(22)23/h8-10,18H,1-7H2,(H,20,24)(H,21,25)(H,22,23)(H,26,27)(H4,16,17,19)/t8?,9-,10+/m0/s1 |
| SMILES | NC(=[NH2+])NCCC[C@H](NC(=O)C1CCCN1)C(=O)N[C@H](CC(=O)[O-])C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H26N6O6/c16-15(17)19-6-2-4-9(20-12(24)8-3-1-5-18-8)13(25)21-10(14(26)27)7-11(22)23/h8-10,18H,1-7H2,(H,20,24)(H,21,25)(H,22,23)(H,26,27)(H4,16,17,19)/t8?,9-,10+/m0/s1 |
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| SMILES (mnx) | [CH2:1]1[CH2:3][CH:8]([C:12](=[N:20][C@@H:9]([CH2:4][CH2:2][CH2:6][NH:19][C:15](=[NH:16])[NH2:17])[C:13](=[N:21][C@H:10]([CH2:7][C:11](=[O:22])[OH:23])[C:14](=[O:26])[OH:27])[OH:25])[OH:24])[NH:18][CH2:5]1 |
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