| Properties | Image |
|---|
| MNX_ID | MNXM963300 |
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| reference | slm:000655685 |
| formula | C68H117NO9P |
| global charge | -1 |
| mol weight | 1123.656 |
| InChIKey | RILFVGXLKJJNAO-BPPQZXCXSA-M |
| InChI | InChI=1S/C68H118NO9P/c1-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-30-32-34-38-42-46-50-54-58-67(71)75-62-65(78-68(72)59-55-51-47-43-39-35-36-40-44-48-52-56-64(3)4)63-77-79(73,74)76-61-60-69-66(70)57-53-49-45-41-37-33-31-29-22-20-18-16-14-12-10-8-6-2/h13-16,19-22,24-25,27-28,31,33,41,45,64-65H,5-12,17-18,23,26,29-30,32,34-40,42-44,46-63H2,1-4H3,(H,69,70)(H,73,74)/p-1/b15-13-,16-14-,21-19-,22-20-,25-24-,28-27-,33-31-,45-41-/t65-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C68H118NO9P/c1-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-30-32-34-38-42-46-50-54-58-67(71)75-62-65(78-68(72)59-55-51-47-43-39-35-36-40-44-48-52-56-64(3)4)63-77-79(73,74)76-61-60-69-66(70)57-53-49-45-41-37-33-31-29-22-20-18-16-14-12-10-8-6-2/h13-16,19-22,24-25,27-28,31,33,41,45,64-65H,5-12,17-18,23,26,29-30,32,34-40,42-44,46-63H2,1-4H3,(H,69,70)(H,73,74)/b15-13-,16-14-,21-19-,22-20-,25-24-,28-27-,33-31-,45-41-/t65-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:30][CH2:32][CH2:34][CH2:38][CH2:42][CH2:46][CH2:50][CH2:54][CH2:58][C:67](=[O:71])[O:75][CH2:62][C@H:65]([CH2:63][O:77][P:79]([OH:73])(=[O:74])[O:76][CH2:61][CH2:60][N:69]=[C:66]([CH2:57][CH2:53][CH2:49]/[CH:45]=[CH:41]\[CH2:37]/[CH:33]=[CH:31]\[CH2:29]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:70])[O:78][C:68]([CH2:59][CH2:55][CH2:51][CH2:47][CH2:43][CH2:39][CH2:35][CH2:36][CH2:40][CH2:44][CH2:48][CH2:52][CH2:56][CH:64]([CH3:3])[CH3:4])=[O:72] |
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