| Properties | Image |
|---|
| MNX_ID | MNXM20400 |
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| reference | keggC:C22273 |
| formula | C34H50N6O11 |
| global charge | 0 |
| mol weight | 718.805 |
| InChIKey | GKIMOVAPSAVJHZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C34H50N6O11/c41-25-9-7-23(19-27(25)43)31(47)39-17-5-13-35-11-1-3-15-37-29(45)21-34(51,33(49)50)22-30(46)38-16-4-2-12-36-14-6-18-40-32(48)24-8-10-26(42)28(44)20-24/h7-10,19-20,35-36,41-44,51H,1-6,11-18,21-22H2,(H,37,45)(H,38,46)(H,39,47)(H,40,48)(H,49,50) |
| SMILES | O=C(CC(O)(CC(=O)NCCCCNCCCNC(=O)C1=CC=C(O)C(O)=C1)C(=O)O)NCCCCNCCCNC(=O)C1=CC=C(O)C(O)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C34H50N6O11/c41-25-9-7-23(19-27(25)43)31(47)39-17-5-13-35-11-1-3-15-37-29(45)21-34(51,33(49)50)22-30(46)38-16-4-2-12-36-14-6-18-40-32(48)24-8-10-26(42)28(44)20-24/h7-10,19-20,35-36,41-44,51H,1-6,11-18,21-22H2,(H,37,45)(H,38,46)(H,39,47)(H,40,48)(H,49,50) |
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| SMILES (mnx) | [CH2:1]([CH2:3][CH2:15][N:37]=[C:29]([CH2:21][C:34]([CH2:22][C:30](=[N:38][CH2:16][CH2:4][CH2:2][CH2:12][NH:36][CH2:14][CH2:6][CH2:18][N:40]=[C:32]([C:24]1=[CH:20][C:28]([OH:44])=[C:26]([OH:42])[CH:10]=[CH:8]1)[OH:48])[OH:46])([C:33](=[O:49])[OH:50])[OH:51])[OH:45])[CH2:11][NH:35][CH2:13][CH2:5][CH2:17][N:39]=[C:31]([C:23]1=[CH:19][C:27]([OH:43])=[C:25]([OH:41])[CH:9]=[CH:7]1)[OH:47] |
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