| Properties | Image |
|---|
| MNX_ID | MNXM1188197 |
 |
| reference | envipathM:...a06b8d5815d1 |
| formula | C34H26N4O11 |
| global charge | 0 |
| mol weight | 666.599 |
| InChIKey | RRIBHMHYEQZFDX-UHFFFAOYSA-N |
| InChI | InChI=1S/C34H26N4O11/c39-18-35-23-9-3-21(4-10-23)30(43)22-5-11-25(12-6-22)38-34(47)49-17-26(41)13-14-48-33(46)37-24-7-1-20(2-8-24)15-27-29(42)16-28(36-19-40)32(45)31(27)44/h1-12,16,42,44-45H,13-15,17H2,(H,37,46)(H,38,47) |
| SMILES | O=C=NC1=CC=C(C(=O)C2=CC=C(NC(=O)OCC(=O)CCOC(=O)NC3=CC=C(CC4=C(O)C(O)=C(N=C=O)C=C4O)C=C3)C=C2)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C34H26N4O11/c39-18-35-23-9-3-21(4-10-23)30(43)22-5-11-25(12-6-22)38-34(47)49-17-26(41)13-14-48-33(46)37-24-7-1-20(2-8-24)15-27-29(42)16-28(36-19-40)32(45)31(27)44/h1-12,16,42,44-45H,13-15,17H2,(H,37,46)(H,38,47) |
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| SMILES (mnx) | [CH:1]1=[CH:7][C:24]([NH:37][C:33](=[O:46])[O:48][CH2:14][CH2:13][C:26]([CH2:17][O:49][C:34]([NH:38][C:25]2=[CH:12][CH:6]=[C:22]([C:30]([C:21]3=[CH:4][CH:10]=[C:23]([N:35]=[C:18]=[O:39])[CH:9]=[CH:3]3)=[O:43])[CH:5]=[CH:11]2)=[O:47])=[O:41])=[CH:8][CH:2]=[C:20]1[CH2:15][C:27]1=[C:29]([OH:42])[CH:16]=[C:28]([N:36]=[C:19]=[O:40])[C:32]([OH:45])=[C:31]1[OH:44] |
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