| Properties | Image |
|---|
| MNX_ID | MNXM174811 |
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| reference | slm:000005349 |
| formula | C66H109NO10P |
| global charge | -1 |
| mol weight | 1107.569 |
| InChIKey | XLVIRRLXQDNCOT-FONUJZSWSA-M |
| InChI | InChI=1S/C66H110NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-64(68)74-59-62(60-75-78(72,73)76-61-63(67)66(70)71)77-65(69)58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-26,29-32,35-38,62-63H,3-10,15-16,21-22,27-28,33-34,39-61,67H2,1-2H3,(H,70,71)(H,72,73)/p-1/b13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-/t62-,63+/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C66H110NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-64(68)74-59-62(60-75-78(72,73)76-61-63(67)66(70)71)77-65(69)58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-26,29-32,35-38,62-63H,3-10,15-16,21-22,27-28,33-34,39-61,67H2,1-2H3,(H,70,71)(H,72,73)/b13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-/t62-,63+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][C:64](=[O:68])[O:74][CH2:59][C@H:62]([CH2:60][O:75][P:78]([OH:72])(=[O:73])[O:76][CH2:61][C@@H:63]([C:66](=[O:70])[OH:71])[NH2:67])[O:77][C:65]([CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42][CH2:40]/[CH:38]=[CH:36]\[CH2:34]/[CH:32]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:69] |
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