| Properties | Image |
|---|
| MNX_ID | MNXM1057920 |
 |
| reference | slm:000750484 |
| formula | C92H159N3O34 |
| global charge | 0 |
| mol weight | 1851.271 |
| InChIKey | MGLRZPNOGNOKKH-OOMNVOLFSA-N |
| InChI | InChI=1S/C92H159N3O34/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-43-45-47-49-67(105)95-59(70(106)60(104)48-46-44-42-40-38-18-16-14-12-10-8-6-2)56-118-89-78(114)76(112)83(65(54-100)123-89)126-90-79(115)77(113)84(66(55-101)124-90)127-92-81(117)86(73(109)63(52-98)121-92)129-88-69(94-58(4)103)75(111)82(64(53-99)122-88)125-91-80(116)85(72(108)62(51-97)120-91)128-87-68(93-57(3)102)74(110)71(107)61(50-96)119-87/h7,9,13,15,19-20,22-23,25-26,28-29,59-66,68-92,96-101,104,106-117H,5-6,8,10-12,14,16-18,21,24,27,30-56H2,1-4H3,(H,93,102)(H,94,103)(H,95,105)/b9-7-,15-13-,20-19-,23-22-,26-25-,29-28-/t59-,60+,61+,62+,63+,64+,65+,66+,68+,69+,70-,71-,72-,73-,74+,75+,76+,77+,78+,79+,80+,81+,82-,83+,84-,85-,86-,87-,88-,89+,90-,91+,92+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O[C@H]5O[C@H](CO)[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6NC(C)=O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C92H159N3O34/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-43-45-47-49-67(105)95-59(70(106)60(104)48-46-44-42-40-38-18-16-14-12-10-8-6-2)56-118-89-78(114)76(112)83(65(54-100)123-89)126-90-79(115)77(113)84(66(55-101)124-90)127-92-81(117)86(73(109)63(52-98)121-92)129-88-69(94-58(4)103)75(111)82(64(53-99)122-88)125-91-80(116)85(72(108)62(51-97)120-91)128-87-68(93-57(3)102)74(110)71(107)61(50-96)119-87/h7,9,13,15,19-20,22-23,25-26,28-29,59-66,68-92,96-101,104,106-117H,5-6,8,10-12,14,16-18,21,24,27,30-56H2,1-4H3,(H,93,102)(H,94,103)(H,95,105)/b9-7-,15-13-,20-19-,23-22-,26-25-,29-28-/t59-,60+,61+,62+,63+,64+,65+,66+,68+,69+,70-,71-,72-,73-,74+,75+,76+,77+,78+,79+,80+,81+,82-,83+,84-,85-,86-,87-,88-,89+,90-,91+,92+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:20]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][C:67](=[N:95][C@@H:59]([CH2:56][O:118][C@H:89]1[C@H:78]([OH:114])[C@@H:76]([OH:112])[C@H:83]([O:126][C@H:90]2[C@H:79]([OH:115])[C@@H:77]([OH:113])[C@@H:84]([O:127][C@@H:92]3[C@H:81]([OH:117])[C@@H:86]([O:129][C@H:88]4[C@H:69]([N:94]=[C:58]([CH3:4])[OH:103])[C@@H:75]([OH:111])[C@@H:82]([O:125][C@@H:91]5[C@H:80]([OH:116])[C@@H:85]([O:128][C@H:87]6[C@H:68]([N:93]=[C:57]([CH3:3])[OH:102])[C@@H:74]([OH:110])[C@@H:71]([OH:107])[C@@H:61]([CH2:50][OH:96])[O:119]6)[C@@H:72]([OH:108])[C@@H:62]([CH2:51][OH:97])[O:120]5)[C@@H:64]([CH2:53][OH:99])[O:122]4)[C@@H:73]([OH:109])[C@@H:63]([CH2:52][OH:98])[O:121]3)[C@@H:66]([CH2:55][OH:101])[O:124]2)[C@@H:65]([CH2:54][OH:100])[O:123]1)[C@@H:70]([C@@H:60]([CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:104])[OH:106])[OH:105] |
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