| Properties | Image |
MNX_ID | MNXM966469 |
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reference | slm:000658854 |
formula | C73H127NO9P |
global charge | -1 |
mol weight | 1193.791 |
InChIKey | AOXGNBSDEBWIGN-IDTKXZJRSA-M |
InChI | InChI=1S/C73H128NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-30-32-33-34-35-36-37-39-40-42-44-46-48-50-52-55-58-61-64-72(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)65-62-59-56-53-51-49-47-45-43-41-38-31-29-27-25-23-21-19-17-14-11-8-5-2/h16-19,22-25,28-31,33-34,41,43,70H,4-15,20-21,26-27,32,35-40,42,44-69H2,1-3H3,(H,74,75)(H,78,79)/p-1/b18-16-,19-17-,24-22-,25-23-,30-28-,31-29-,34-33-,43-41-/t70-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
InChI (mnx) | InChI=1/C73H128NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-30-32-33-34-35-36-37-39-40-42-44-46-48-50-52-55-58-61-64-72(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)65-62-59-56-53-51-49-47-45-43-41-38-31-29-27-25-23-21-19-17-14-11-8-5-2/h16-19,22-25,28-31,33-34,41,43,70H,4-15,20-21,26-27,32,35-40,42,44-69H2,1-3H3,(H,74,75)(H,78,79)/b18-16-,19-17-,24-22-,25-23-,30-28-,31-29-,34-33-,43-41-/t70-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:36][CH2:37][CH2:39][CH2:40][CH2:42][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][CH2:51][CH2:49][CH2:47][CH2:45]/[CH:43]=[CH:41]\[CH2:38]/[CH:31]=[CH:29]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:77] |
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