| Properties | Image |
|---|
| MNX_ID | MNXM963714 |
 |
| reference | slm:000656099 |
| formula | C69H119NO9P |
| global charge | -1 |
| mol weight | 1137.683 |
| InChIKey | WVQXBTLQVGOBOG-GFIZWTAOSA-M |
| InChI | InChI=1S/C69H120NO9P/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-33-34-35-36-38-39-42-45-48-51-54-57-60-68(72)76-64-66(79-69(73)61-58-55-52-49-46-43-40-37-28-26-23-20-17-14-11-8-5-2)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-41-24-21-18-15-12-9-6-3/h8,11,16-17,19-20,25-28,30-31,33-34,40,43,66H,4-7,9-10,12-15,18,21-24,29,32,35-39,41-42,44-65H2,1-3H3,(H,70,71)(H,74,75)/p-1/b11-8-,19-16-,20-17-,27-25-,28-26-,31-30-,34-33-,43-40-/t66-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H120NO9P/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-33-34-35-36-38-39-42-45-48-51-54-57-60-68(72)76-64-66(79-69(73)61-58-55-52-49-46-43-40-37-28-26-23-20-17-14-11-8-5-2)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-41-24-21-18-15-12-9-6-3/h8,11,16-17,19-20,25-28,30-31,33-34,40,43,66H,4-7,9-10,12-15,18,21-24,29,32,35-39,41-42,44-65H2,1-3H3,(H,70,71)(H,74,75)/b11-8-,19-16-,20-17-,27-25-,28-26-,31-30-,34-33-,43-40-/t66-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:36][CH2:38][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][C:68](=[O:72])[O:76][CH2:64][C@H:66]([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][CH2:50][CH2:47][CH2:44][CH2:41][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:71])[O:79][C:69]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46]/[CH:43]=[CH:40]\[CH2:37]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:73] |
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