| Properties | Image |
|---|
| MNX_ID | MNXM744716 |
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| reference | biggM:gluilelys |
| formula | C17H32N4O6 |
| global charge | 0 |
| mol weight | 388.465 |
| InChIKey | XTZDZAXYPDISRR-WLNALFRTSA-N |
| InChI | InChI=1S/C17H32N4O6/c1-3-10(2)14(21-15(24)11(19)7-8-13(22)23)16(25)20-12(17(26)27)6-4-5-9-18/h10-12,14H,3-9,18-19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t10?,11-,12-,14+/m1/s1 |
| SMILES | CCC(C)[C@H](NC(=O)[C@H](N)CCC(=O)[O-])C(=O)N[C@H](CCCC[NH3+])C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H32N4O6/c1-3-10(2)14(21-15(24)11(19)7-8-13(22)23)16(25)20-12(17(26)27)6-4-5-9-18/h10-12,14H,3-9,18-19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t10?,11-,12-,14+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH:10]([CH3:2])[C@@H:14]([C:16](=[N:20][C@H:12]([CH2:6][CH2:4][CH2:5][CH2:9][NH2:18])[C:17](=[O:26])[OH:27])[OH:25])[N:21]=[C:15]([C@@H:11]([CH2:7][CH2:8][C:13](=[O:22])[OH:23])[NH2:19])[OH:24] |
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