| Properties | Image |
|---|
| MNX_ID | MNXM526157 |
 |
| reference | envipathM:...48eeddc78cee |
| formula | C51H107N18O14 |
| global charge | -7 |
| mol weight | 1196.529 |
| InChIKey | MBGYKMXAIPJVAQ-UHFFFAOYSA-G |
| InChI | InChI=1S/C19H43N9.C9H21N5.C9H22N4.7C2H4O2/c20-17(21)26-13-9-5-1-3-7-11-15-28(19(24)25)16-12-8-4-2-6-10-14-27-18(22)23;10-9(11)13-7-5-3-1-2-4-6-8-14-12;10-7-5-3-1-2-4-6-8-13-9(11)12;7*1-2(3)4/h1-16H2,(H3,24,25)(H4,20,21,26)(H4,22,23,27);14H,1-8H2,(H4,10,11,13);1-8,10H2,(H4,11,12,13);7*1H3,(H,3,4)/p-7 |
| SMILES | CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].N=C(N)NCCCCCCCCN.N=C(N)NCCCCCCCCN(CCCCCCCCNC(=N)N)C(=N)N.[N]NCCCCCCCCNC(=N)N |
MNX internals
| InChI (mnx) | InChI=1/C19H43N9.C9H21N5.C9H22N4.7C2H4O2/c20-17(21)26-13-9-5-1-3-7-11-15-28(19(24)25)16-12-8-4-2-6-10-14-27-18(22)23;10-9(11)13-7-5-3-1-2-4-6-8-14-12;10-7-5-3-1-2-4-6-8-13-9(11)12;7*1-2(3)4/h1-16H2,(H3,24,25)(H4,20,21,26)(H4,22,23,27);14H,1-8H2,(H4,10,11,13);1-8,10H2,(H4,11,12,13);7*1H3,(H,3,4) |
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| SMILES (mnx) | [CH2:1]([CH2:3][CH2:7][CH2:11][CH2:15][N:28]([CH2:16][CH2:12][CH2:8][CH2:4][CH2:2][CH2:6][CH2:10][CH2:14][NH:27][C:18](=[NH:22])[NH2:23])[C:19](=[NH:24])[NH2:25])[CH2:5][CH2:9][CH2:13][NH:26][C:17](=[NH:20])[NH2:21].[CH2:29]([CH2:30][CH2:32][CH2:34][CH2:36][NH:42][N:40])[CH2:31][CH2:33][CH2:35][NH:41][C:37](=[NH:38])[NH2:39].[CH2:43]([CH2:44][CH2:46][CH2:48][CH2:50][NH:55][C:51](=[NH:53])[NH2:54])[CH2:45][CH2:47][CH2:49][NH2:52].[CH3:56][C:57](=[O:58])[OH:59].[CH3:60][C:61](=[O:62])[OH:63].[CH3:64][C:65](=[O:66])[OH:67].[CH3:68][C:69](=[O:70])[OH:71].[CH3:72][C:73](=[O:74])[OH:75].[CH3:76][C:77](=[O:78])[OH:79].[CH3:80][C:81](=[O:82])[OH:83] |
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