| Properties | Image |
|---|
| MNX_ID | MNXM938577 |
 |
| reference | slm:000630962 |
| formula | C70H125NO9P |
| global charge | -1 |
| mol weight | 1155.742 |
| InChIKey | ZQJREOZDRFBDPA-WXPQJJKBSA-M |
| InChI | InChI=1S/C70H126NO9P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-48-52-56-60-69(73)77-64-67(80-70(74)61-57-53-49-45-46-50-54-58-66(3)4)65-79-81(75,76)78-63-62-71-68(72)59-55-51-47-43-41-39-37-20-18-16-14-12-10-8-6-2/h7,9,13,15-16,18-19,21,23-24,26-27,66-67H,5-6,8,10-12,14,17,20,22,25,28-65H2,1-4H3,(H,71,72)(H,75,76)/p-1/b9-7-,15-13-,18-16-,21-19-,24-23-,27-26-/t67-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C70H126NO9P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-48-52-56-60-69(73)77-64-67(80-70(74)61-57-53-49-45-46-50-54-58-66(3)4)65-79-81(75,76)78-63-62-71-68(72)59-55-51-47-43-41-39-37-20-18-16-14-12-10-8-6-2/h7,9,13,15-16,18-19,21,23-24,26-27,66-67H,5-6,8,10-12,14,17,20,22,25,28-65H2,1-4H3,(H,71,72)(H,75,76)/b9-7-,15-13-,18-16-,21-19-,24-23-,27-26-/t67-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:48][CH2:52][CH2:56][CH2:60][C:69](=[O:73])[O:77][CH2:64][C@H:67]([CH2:65][O:79][P:81]([OH:75])(=[O:76])[O:78][CH2:63][CH2:62][N:71]=[C:68]([CH2:59][CH2:55][CH2:51][CH2:47][CH2:43][CH2:41][CH2:39][CH2:37][CH2:20]/[CH:18]=[CH:16]\[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:72])[O:80][C:70]([CH2:61][CH2:57][CH2:53][CH2:49][CH2:45][CH2:46][CH2:50][CH2:54][CH2:58][CH:66]([CH3:3])[CH3:4])=[O:74] |
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