| Properties | Image |
|---|
| MNX_ID | MNXM959217 |
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| reference | slm:000651602 |
| formula | C65H107NO9P |
| global charge | -1 |
| mol weight | 1077.543 |
| InChIKey | PAYPLZULFUFDJU-VRTGQGRBSA-M |
| InChI | InChI=1S/C65H108NO9P/c1-4-7-10-13-16-18-20-22-24-26-27-28-29-30-31-32-33-34-35-37-39-41-43-45-48-51-54-57-65(69)75-62(61-74-76(70,71)73-59-58-66-63(67)55-52-49-46-15-12-9-6-3)60-72-64(68)56-53-50-47-44-42-40-38-36-25-23-21-19-17-14-11-8-5-2/h7,10,16-19,22-25,27-28,30-31,33-34,38,40,44,47,62H,4-6,8-9,11-15,20-21,26,29,32,35-37,39,41-43,45-46,48-61H2,1-3H3,(H,66,67)(H,70,71)/p-1/b10-7-,18-16-,19-17-,24-22-,25-23-,28-27-,31-30-,34-33-,40-38-,47-44-/t62-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)O[C@H](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C65H108NO9P/c1-4-7-10-13-16-18-20-22-24-26-27-28-29-30-31-32-33-34-35-37-39-41-43-45-48-51-54-57-65(69)75-62(61-74-76(70,71)73-59-58-66-63(67)55-52-49-46-15-12-9-6-3)60-72-64(68)56-53-50-47-44-42-40-38-36-25-23-21-19-17-14-11-8-5-2/h7,10,16-19,22-25,27-28,30-31,33-34,38,40,44,47,62H,4-6,8-9,11-15,20-21,26,29,32,35-37,39,41-43,45-46,48-61H2,1-3H3,(H,66,67)(H,70,71)/b10-7-,18-16-,19-17-,24-22-,25-23-,28-27-,31-30-,34-33-,40-38-,47-44-/t62-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:65](=[O:69])[O:75][C@H:62]([CH2:60][O:72][C:64]([CH2:56][CH2:53][CH2:50]/[CH:47]=[CH:44]\[CH2:42]/[CH:40]=[CH:38]\[CH2:36]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68])[CH2:61][O:74][P:76]([OH:70])(=[O:71])[O:73][CH2:59][CH2:58][N:66]=[C:63]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:67] |
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