| Properties | Image |
|---|
| MNX_ID | MNXM1196297 |
 |
| reference | envipathM:...a3b8bc58c735 |
| formula | C22H24N3O10 |
| global charge | -1 |
| mol weight | 490.445 |
| InChIKey | ZRAYIUQYDBGDMW-WUDVTJOCSA-M |
| InChI | InChI=1S/C22H25N3O10/c1-5-25-8-14(16(29)13-7-6-10(2)23-20(13)25)21(31)24-15(9-26)18(34-11(3)27)19(35-12(4)28)17(30)22(32)33/h6-9,15,17-19,30H,5H2,1-4H3,(H,24,31)(H,32,33)/p-1/t15-,17-,18-,19?/m1/s1 |
| SMILES | CCN1C=C(C(=O)N[C@H](C=O)[C@@H](OC(C)=O)C(OC(C)=O)[C@@H](O)C(=O)[O-])C(=O)C2=CC=C(C)N=C21 |
MNX internals
| InChI (mnx) | InChI=1/C22H25N3O10/c1-5-25-8-14(16(29)13-7-6-10(2)23-20(13)25)21(31)24-15(9-26)18(34-11(3)27)19(35-12(4)28)17(30)22(32)33/h6-9,15,17-19,30H,5H2,1-4H3,(H,24,31)(H,32,33)/t15-,17-,18-,19?/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][N:25]1[CH:8]=[C:14]([C:21](=[N:24][C@H:15]([CH:9]=[O:26])[C@H:18]([CH:19]([C@H:17]([C:22](=[O:32])[OH:33])[OH:30])[O:35][C:12]([CH3:4])=[O:28])[O:34][C:11]([CH3:3])=[O:27])[OH:31])[C:16](=[O:29])[C:13]2=[C:20]1[N:23]=[C:10]([CH3:2])[CH:6]=[CH:7]2 |
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