| Properties | Image |
|---|
| MNX_ID | MNXM957182 |
 |
| reference | slm:000649567 |
| formula | C69H111NO9P |
| global charge | -1 |
| mol weight | 1129.619 |
| InChIKey | LVFYLNBWJJMJKV-URNBVSNHSA-M |
| InChI | InChI=1S/C69H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-32-33-34-37-40-43-46-49-52-55-58-61-69(73)79-66(64-76-68(72)60-57-54-51-48-45-42-39-36-30-27-24-21-18-15-12-9-6-3)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-41-38-35-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,32-33,37-42,46-47,49-50,66H,4-15,22-24,31,34-36,43-45,48,51-65H2,1-3H3,(H,70,71)(H,74,75)/p-1/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,33-32-,40-37-,41-38-,42-39-,49-46-,50-47-/t66-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-32-33-34-37-40-43-46-49-52-55-58-61-69(73)79-66(64-76-68(72)60-57-54-51-48-45-42-39-36-30-27-24-21-18-15-12-9-6-3)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-41-38-35-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,32-33,37-42,46-47,49-50,66H,4-15,22-24,31,34-36,43-45,48,51-65H2,1-3H3,(H,70,71)(H,74,75)/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,33-32-,40-37-,41-38-,42-39-,49-46-,50-47-/t66-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34]/[CH:37]=[CH:40]\[CH2:43]/[CH:46]=[CH:49]\[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][CH2:48][CH2:45]/[CH:42]=[CH:39]\[CH2:36]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[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]/[CH:50]=[CH:47]\[CH2:44]/[CH:41]=[CH:38]\[CH2:35]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:71] |
|