| Properties | Image |
|---|
| MNX_ID | MNXM967371 |
 |
| reference | slm:000659756 |
| formula | C97H161NO9P |
| global charge | -1 |
| mol weight | 1516.327 |
| InChIKey | PCNVKNUWJGBDIY-FJFNZQOWSA-M |
| InChI | InChI=1S/C97H162NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-40-42-44-46-47-49-51-53-55-57-59-62-65-68-71-74-77-80-83-86-89-97(101)107-94(93-106-108(102,103)105-91-90-98-95(99)87-84-81-78-75-72-69-66-63-60-33-30-27-24-21-18-15-12-9-6-3)92-104-96(100)88-85-82-79-76-73-70-67-64-61-58-56-54-52-50-48-45-43-41-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-30,34-37,40-43,60,63,69,72,78,81,94H,4-6,8,11,13-15,22-24,31-33,38-39,44-59,61-62,64-68,70-71,73-77,79-80,82-93H2,1-3H3,(H,98,99)(H,102,103)/p-1/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,37-35-,42-40-,43-41-,63-60-,72-69-,81-78-/t94-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC |
MNX internals
| InChI (mnx) | InChI=1/C97H162NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-40-42-44-46-47-49-51-53-55-57-59-62-65-68-71-74-77-80-83-86-89-97(101)107-94(93-106-108(102,103)105-91-90-98-95(99)87-84-81-78-75-72-69-66-63-60-33-30-27-24-21-18-15-12-9-6-3)92-104-96(100)88-85-82-79-76-73-70-67-64-61-58-56-54-52-50-48-45-43-41-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-30,34-37,40-43,60,63,69,72,78,81,94H,4-6,8,11,13-15,22-24,31-33,38-39,44-59,61-62,64-68,70-71,73-77,79-80,82-93H2,1-3H3,(H,98,99)(H,102,103)/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,37-35-,42-40-,43-41-,63-60-,72-69-,81-78-/t94-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:34]=[CH:36]\[CH2:38]/[CH:40]=[CH:42]\[CH2:44][CH2:46][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][CH2:74][CH2:77][CH2:80][CH2:83][CH2:86][CH2:89][C:97](=[O:101])[O:107][C@H:94]([CH2:92][O:104][C:96]([CH2:88][CH2:85][CH2:82][CH2:79][CH2:76][CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:45]/[CH:43]=[CH:41]\[CH2:39]/[CH:37]=[CH:35]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:100])[CH2:93][O:106][P:108]([OH:102])(=[O:103])[O:105][CH2:91][CH2:90][N:98]=[C:95]([CH2:87][CH2:84]/[CH:81]=[CH:78]\[CH2:75]/[CH:72]=[CH:69]\[CH2:66]/[CH:63]=[CH:60]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])[OH:99] |
|