| Properties | Image |
|---|
| MNX_ID | MNXM1176722 |
 |
| reference | envipathM:...017ac9268642 |
| formula | C23H27N5O7 |
| global charge | -2 |
| mol weight | 485.497 |
| InChIKey | GULZQJIPBJVWNQ-LFIBNONCSA-L |
| InChI | InChI=1S/C23H29N5O7/c1-4-5-6-18(29)28(19(13(2)3)22(32)33)12-14-7-9-15(10-8-14)16(11-17-24-26-27-25-17)20(30)21(31)23(34)35/h7-11,13,19-20,30H,4-6,12H2,1-3H3,(H,32,33)(H,34,35)(H,24,25,26,27)/p-2/b16-11+ |
| SMILES | CCCCC(=O)N(CC1=CC=C(/C(=C\C2=NNN=N2)C(O)C(=O)C(=O)[O-])C=C1)C(C(=O)[O-])C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C23H29N5O7/c1-4-5-6-18(29)28(19(13(2)3)22(32)33)12-14-7-9-15(10-8-14)16(11-17-24-26-27-25-17)20(30)21(31)23(34)35/h7-11,13,19-20,30H,4-6,12H2,1-3H3,(H,32,33)(H,34,35)(H,24,25,26,27)/b16-11+/t19?,20? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][C:18]([N:28]([CH2:12][C:14]1=[CH:8][CH:10]=[C:15](/[C:16](=[CH:11]\[C:17]2=[N:24][NH:26][N:27]=[N:25]2)[CH:20]([C:21]([C:23]([OH:34])=[O:35])=[O:31])[OH:30])[CH:9]=[CH:7]1)[CH:19]([CH:13]([CH3:2])[CH3:3])[C:22](=[O:32])[OH:33])=[O:29] |
|