| Properties | Image |
|---|
| MNX_ID | MNXM956129 |
 |
| reference | slm:000648514 |
| formula | C65H107NO9P |
| global charge | -1 |
| mol weight | 1077.543 |
| InChIKey | YQVWIGGHRFKAEK-HNCREYQOSA-M |
| InChI | InChI=1S/C65H108NO9P/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-37-40-43-46-49-52-55-63(67)66-58-59-73-76(70,71)74-61-62(60-72-64(68)56-53-50-47-44-41-38-34-27-24-21-18-15-12-9-6-3)75-65(69)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h7,10,16,18-19,21,25-29,31,33-34,37,40-41,44,46,49,62H,4-6,8-9,11-15,17,20,22-24,30,32,35-36,38-39,42-43,45,47-48,50-61H2,1-3H3,(H,66,67)(H,70,71)/p-1/b10-7-,19-16-,21-18-,28-25-,29-26-,33-31-,34-27-,40-37-,44-41-,49-46-/t62-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C65H108NO9P/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-37-40-43-46-49-52-55-63(67)66-58-59-73-76(70,71)74-61-62(60-72-64(68)56-53-50-47-44-41-38-34-27-24-21-18-15-12-9-6-3)75-65(69)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h7,10,16,18-19,21,25-29,31,33-34,37,40-41,44,46,49,62H,4-6,8-9,11-15,17,20,22-24,30,32,35-36,38-39,42-43,45,47-48,50-61H2,1-3H3,(H,66,67)(H,70,71)/b10-7-,19-16-,21-18-,28-25-,29-26-,33-31-,34-27-,40-37-,44-41-,49-46-/t62-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:31]=[CH:33]\[CH2:35]/[CH:37]=[CH:40]\[CH2:43]/[CH:46]=[CH:49]\[CH2:52][CH2:55][C:63](=[N:66][CH2:58][CH2:59][O:73][P:76]([OH:70])(=[O:71])[O:74][CH2:61][C@@H:62]([CH2:60][O:72][C:64]([CH2:56][CH2:53][CH2:50][CH2:47]/[CH:44]=[CH:41]\[CH2:38]/[CH:34]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:68])[O:75][C:65]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:32]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:69])[OH:67] |
|