| Properties | Image |
MNX_ID | MNXM939043 |
 |
reference | slm:000631428 |
formula | C73H123NO9P |
global charge | -1 |
mol weight | 1189.759 |
InChIKey | COUQTSDBPWYFOB-FPKSHNMWSA-M |
InChI | InChI=1S/C73H124NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-44-46-48-50-52-55-58-61-64-72(76)80-68-70(69-82-84(78,79)81-67-66-74-71(75)63-60-57-54-15-12-9-6-3)83-73(77)65-62-59-56-53-51-49-47-45-42-27-25-23-21-19-17-14-11-8-5-2/h7-8,10-11,16-19,22-25,28-29,31-32,42,45,49,51,70H,4-6,9,12-15,20-21,26-27,30,33-41,43-44,46-48,50,52-69H2,1-3H3,(H,74,75)(H,78,79)/p-1/b10-7-,11-8-,18-16-,19-17-,24-22-,25-23-,29-28-,32-31-,45-42-,51-49-/t70-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC |
MNX internals
InChI (mnx) | InChI=1/C73H124NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-44-46-48-50-52-55-58-61-64-72(76)80-68-70(69-82-84(78,79)81-67-66-74-71(75)63-60-57-54-15-12-9-6-3)83-73(77)65-62-59-56-53-51-49-47-45-42-27-25-23-21-19-17-14-11-8-5-2/h7-8,10-11,16-19,22-25,28-29,31-32,42,45,49,51,70H,4-6,9,12-15,20-21,26-27,30,33-41,43-44,46-48,50,52-69H2,1-3H3,(H,74,75)(H,78,79)/b10-7-,11-8-,18-16-,19-17-,24-22-,25-23-,29-28-,32-31-,45-42-,51-49-/t70-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:43][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][C:72](=[O:76])[O:80][CH2:68][C@H:70]([CH2:69][O:82][P:84]([OH:78])(=[O:79])[O:81][CH2:67][CH2:66][N:74]=[C:71]([CH2:63][CH2:60][CH2:57][CH2:54][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:75])[O:83][C:73]([CH2:65][CH2:62][CH2:59][CH2:56][CH2:53]/[CH:51]=[CH:49]\[CH2:47]/[CH:45]=[CH:42]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:77] |
|