| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1376222 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
0 |
|
formula | C14H17N2O7 |
charge | -1 |
mass | 325.297 |
reference | metacycM:CPD-12136 |
InChIKey | RYBKCROHRDEYCF-UHFFFAOYSA-M |
InChI | InChI=1S/C14H18N2O7/c15-9(13(20)21)4-6-1-2-11(17)7(3-6)8(12(18)19)5-10(16)14(22)23/h1-3,6,8-10H,4-5,15-16H2,(H,18,19)(H,20,21)(H,22,23)/p-1 |
SMILES | [CH:1]1=[CH:2][C:11](=[O:17])[C:7]([CH:8]([CH2:5][CH:10]([C:14](=[O:22])[OH:23])[NH2:16])[C:12](=[O:18])[OH:19])=[CH:3][CH:6]1[CH2:4][CH:9]([C:13](=[O:20])[OH:21])[NH2:15] |
|