| Properties | Image |
|---|
| MNX_ID | MNXM1059996 |
 |
| reference | slm:000752584 |
| formula | C77H143NO33 |
| global charge | 0 |
| mol weight | 1610.965 |
| InChIKey | DJMJORXBWNLIAQ-FAAGHVOASA-N |
| InChI | InChI=1S/C77H143NO33/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-53(86)78-45(46(85)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2)44-100-72-62(95)59(92)67(51(42-83)105-72)107-74-63(96)60(93)68(52(43-84)106-74)108-75-64(97)70(56(89)48(39-80)102-75)110-77-66(99)71(57(90)50(41-82)104-77)111-76-65(98)69(55(88)49(40-81)103-76)109-73-61(94)58(91)54(87)47(38-79)101-73/h45-52,54-77,79-85,87-99H,3-44H2,1-2H3,(H,78,86)/t45-,46+,47+,48+,49+,50+,51+,52+,54-,55-,56-,57-,58-,59+,60+,61+,62+,63+,64+,65+,66+,67+,68-,69-,70-,71-,72+,73+,74-,75+,76+,77+/m0/s1 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCC(=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](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]6O)[C@H]5O)[C@H]4O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C77H143NO33/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-53(86)78-45(46(85)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2)44-100-72-62(95)59(92)67(51(42-83)105-72)107-74-63(96)60(93)68(52(43-84)106-74)108-75-64(97)70(56(89)48(39-80)102-75)110-77-66(99)71(57(90)50(41-82)104-77)111-76-65(98)69(55(88)49(40-81)103-76)109-73-61(94)58(91)54(87)47(38-79)101-73/h45-52,54-77,79-85,87-99H,3-44H2,1-2H3,(H,78,86)/t45-,46+,47+,48+,49+,50+,51+,52+,54-,55-,56-,57-,58-,59+,60+,61+,62+,63+,64+,65+,66+,67+,68-,69-,70-,71-,72+,73+,74-,75+,76+,77+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][C:53](=[N:78][C@@H:45]([CH2:44][O:100][C@H:72]1[C@H:62]([OH:95])[C@@H:59]([OH:92])[C@H:67]([O:107][C@H:74]2[C@H:63]([OH:96])[C@@H:60]([OH:93])[C@@H:68]([O:108][C@@H:75]3[C@H:64]([OH:97])[C@@H:70]([O:110][C@@H:77]4[C@H:66]([OH:99])[C@@H:71]([O:111][C@@H:76]5[C@H:65]([OH:98])[C@@H:69]([O:109][C@@H:73]6[C@H:61]([OH:94])[C@@H:58]([OH:91])[C@@H:54]([OH:87])[C@@H:47]([CH2:38][OH:79])[O:101]6)[C@@H:55]([OH:88])[C@@H:49]([CH2:40][OH:81])[O:103]5)[C@@H:57]([OH:90])[C@@H:50]([CH2:41][OH:82])[O:104]4)[C@@H:56]([OH:89])[C@@H:48]([CH2:39][OH:80])[O:102]3)[C@@H:52]([CH2:43][OH:84])[O:106]2)[C@@H:51]([CH2:42][OH:83])[O:105]1)[C@@H:46]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:85])[OH:86] |
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