| Properties | Image |
|---|
| MNX_ID | MNXM938883 |
 |
| reference | slm:000631268 |
| formula | C77H135NO9P |
| global charge | -1 |
| mol weight | 1249.899 |
| InChIKey | GMZYVGDVSCQCDQ-DTLWQRKUSA-M |
| InChI | InChI=1S/C77H136NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-48-50-53-56-59-62-65-68-76(80)84-72-74(87-77(81)69-66-63-60-57-54-51-47-27-24-21-18-15-12-9-6-3)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-26,28,30-31,33-34,46,52,55,74H,4-6,8-9,11-15,18,21-24,27,29,32,35-45,47-51,53-54,56-73H2,1-3H3,(H,78,79)(H,82,83)/p-1/b10-7-,19-16-,20-17-,28-25-,31-30-,34-33-,46-26-,55-52-/t74-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C77H136NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-48-50-53-56-59-62-65-68-76(80)84-72-74(87-77(81)69-66-63-60-57-54-51-47-27-24-21-18-15-12-9-6-3)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-26,28,30-31,33-34,46,52,55,74H,4-6,8-9,11-15,18,21-24,27,29,32,35-45,47-51,53-54,56-73H2,1-3H3,(H,78,79)(H,82,83)/b10-7-,19-16-,20-17-,28-25-,31-30-,34-33-,46-26-,55-52-/t74-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][C:76](=[O:80])[O:84][CH2:72][C@H:74]([CH2:73][O:86][P:88]([OH:82])(=[O:83])[O:85][CH2:71][CH2:70][N:78]=[C:75]([CH2:67][CH2:64][CH2:61][CH2:58]/[CH:55]=[CH:52]\[CH2:49]/[CH:46]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:79])[O:87][C:77]([CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:47][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:81] |
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