| Properties | Image |
|---|
| MNX_ID | MNXM961050 |
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| reference | slm:000653435 |
| formula | C69H117NO9P |
| global charge | -1 |
| mol weight | 1135.667 |
| InChIKey | VNCREFWPMMPEGW-XBUTUFEVSA-M |
| InChI | InChI=1S/C69H118NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-55-58-61-69(73)79-66(65-78-80(74,75)77-63-62-70-67(71)59-56-53-12-9-6-3)64-76-68(72)60-57-54-51-49-47-45-43-41-39-26-24-22-20-18-16-14-11-8-5-2/h15-18,21-24,27-28,30-31,33-34,39,41,45,47,66H,4-14,19-20,25-26,29,32,35-38,40,42-44,46,48-65H2,1-3H3,(H,70,71)(H,74,75)/p-1/b17-15-,18-16-,23-21-,24-22-,28-27-,31-30-,34-33-,41-39-,47-45-/t66-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H118NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-55-58-61-69(73)79-66(65-78-80(74,75)77-63-62-70-67(71)59-56-53-12-9-6-3)64-76-68(72)60-57-54-51-49-47-45-43-41-39-26-24-22-20-18-16-14-11-8-5-2/h15-18,21-24,27-28,30-31,33-34,39,41,45,47,66H,4-14,19-20,25-26,29,32,35-38,40,42-44,46,48-65H2,1-3H3,(H,70,71)(H,74,75)/b17-15-,18-16-,23-21-,24-22-,28-27-,31-30-,34-33-,41-39-,47-45-/t66-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:55][CH2:58][CH2:61][C:69](=[O:73])[O:79][C@H:66]([CH2:64][O:76][C:68]([CH2:60][CH2:57][CH2:54][CH2:51][CH2:49]/[CH:47]=[CH:45]\[CH2:43]/[CH:41]=[CH:39]\[CH2:26]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:72])[CH2:65][O:78][P:80]([OH:74])(=[O:75])[O:77][CH2:63][CH2:62][N:70]=[C:67]([CH2:59][CH2:56][CH2:53][CH2:12][CH2:9][CH2:6][CH3:3])[OH:71] |
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