| Properties | Image |
|---|
| MNX_ID | MNXM193538 |
 |
| reference | slm:000008179 |
| formula | C66H112NO8P |
| global charge | 0 |
| mol weight | 1078.595 |
| InChIKey | GQXIAIQVVQSZPV-SGSGFYSPSA-N |
| InChI | InChI=1S/C66H112NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-31-32-33-34-35-37-39-41-43-45-47-49-51-53-55-57-59-66(69)75-64(63-74-76(70,71)73-61-60-67(3,4)5)62-72-65(68)58-56-54-52-50-48-46-44-42-40-38-36-29-27-25-23-21-19-17-15-13-11-9-7-2/h8-11,14-17,20-23,26-29,31-32,38,40,64H,6-7,12-13,18-19,24-25,30,33-37,39,41-63H2,1-5H3/b10-8-,11-9-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,32-31-,40-38-/t64-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCC[N+](C)(C)C |
MNX internals
| InChI (mnx) | InChI=1/C66H112NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-31-32-33-34-35-37-39-41-43-45-47-49-51-53-55-57-59-66(69)75-64(63-74-76(70,71)73-61-60-67(3,4)5)62-72-65(68)58-56-54-52-50-48-46-44-42-40-38-36-29-27-25-23-21-19-17-15-13-11-9-7-2/h8-11,14-17,20-23,26-29,31-32,38,40,64H,6-7,12-13,18-19,24-25,30,33-37,39,41-63H2,1-5H3/b10-8-,11-9-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,32-31-,40-38-/t64-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][CH2:59][C:66](=[O:69])[O:75][C@H:64]([CH2:62][O:72][C:65]([CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42]/[CH:40]=[CH:38]\[CH2:36]/[CH:29]=[CH:27]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13]/[CH:11]=[CH:9]\[CH2:7][CH3:2])=[O:68])[CH2:63][O:74][P:76](=[O:70])([O-:71])[O:73][CH2:61][CH2:60][N+:67]([CH3:3])([CH3:4])[CH3:5] |
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