| Properties | Image |
|---|
| MNX_ID | MNXM1058968 |
 |
| reference | slm:000751540 |
| formula | C73H133N3O34 |
| global charge | 0 |
| mol weight | 1596.854 |
| InChIKey | RDKMNSUYSUKXAU-JJYGWRNCSA-N |
| InChI | InChI=1S/C73H133N3O34/c1-6-7-8-9-10-11-12-13-16-19-22-25-28-41(84)51(86)40(76-48(85)29-26-23-20-17-14-15-18-21-24-27-37(2)3)35-99-70-61(96)58(93)64(45(33-80)104-70)107-72-62(97)59(94)65(46(34-81)105-72)108-73-63(98)67(54(89)44(32-79)103-73)110-69-50(75-39(5)83)66(109-71-60(95)57(92)53(88)43(31-78)102-71)55(90)47(106-69)36-100-68-49(74-38(4)82)56(91)52(87)42(30-77)101-68/h37,40-47,49-73,77-81,84,86-98H,6-36H2,1-5H3,(H,74,82)(H,75,83)(H,76,85)/t40-,41+,42+,43+,44+,45+,46+,47+,49+,50+,51-,52+,53-,54-,55-,56+,57-,58+,59+,60+,61+,62+,63+,64+,65-,66+,67-,68+,69-,70+,71-,72-,73+/m0/s1 |
| SMILES | CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[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]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H]4NC(C)=O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C73H133N3O34/c1-6-7-8-9-10-11-12-13-16-19-22-25-28-41(84)51(86)40(76-48(85)29-26-23-20-17-14-15-18-21-24-27-37(2)3)35-99-70-61(96)58(93)64(45(33-80)104-70)107-72-62(97)59(94)65(46(34-81)105-72)108-73-63(98)67(54(89)44(32-79)103-73)110-69-50(75-39(5)83)66(109-71-60(95)57(92)53(88)43(31-78)102-71)55(90)47(106-69)36-100-68-49(74-38(4)82)56(91)52(87)42(30-77)101-68/h37,40-47,49-73,77-81,84,86-98H,6-36H2,1-5H3,(H,74,82)(H,75,83)(H,76,85)/t40-,41+,42+,43+,44+,45+,46+,47+,49+,50+,51-,52+,53-,54-,55-,56+,57-,58+,59+,60+,61+,62+,63+,64+,65-,66+,67-,68+,69-,70+,71-,72-,73+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][C@H:41]([C@H:51]([C@H:40]([CH2:35][O:99][C@H:70]1[C@H:61]([OH:96])[C@@H:58]([OH:93])[C@H:64]([O:107][C@H:72]2[C@H:62]([OH:97])[C@@H:59]([OH:94])[C@@H:65]([O:108][C@@H:73]3[C@H:63]([OH:98])[C@@H:67]([O:110][C@H:69]4[C@H:50]([N:75]=[C:39]([CH3:5])[OH:83])[C@@H:66]([O:109][C@H:71]5[C@H:60]([OH:95])[C@@H:57]([OH:92])[C@@H:53]([OH:88])[C@@H:43]([CH2:31][OH:78])[O:102]5)[C@@H:55]([OH:90])[C@@H:47]([CH2:36][O:100][C@H:68]5[C@H:49]([N:74]=[C:38]([CH3:4])[OH:82])[C@@H:56]([OH:91])[C@H:52]([OH:87])[C@@H:42]([CH2:30][OH:77])[O:101]5)[O:106]4)[C@@H:54]([OH:89])[C@@H:44]([CH2:32][OH:79])[O:103]3)[C@@H:46]([CH2:34][OH:81])[O:105]2)[C@@H:45]([CH2:33][OH:80])[O:104]1)[N:76]=[C:48]([CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:15][CH2:18][CH2:21][CH2:24][CH2:27][CH:37]([CH3:2])[CH3:3])[OH:85])[OH:86])[OH:84] |
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