| Properties | Image |
MNX_ID | MNXM938924 |
 |
reference | slm:000631309 |
formula | C83H149NO9P |
global charge | -1 |
mol weight | 1336.077 |
InChIKey | PRZVGALWODYZAY-ZEVHGILRSA-M |
InChI | InChI=1S/C83H150NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-36-37-38-39-40-41-42-43-44-45-47-48-50-53-56-59-62-65-68-71-74-82(86)90-78-80(93-83(87)75-72-69-66-63-60-57-54-51-49-46-33-31-29-26-23-20-17-14-11-8-5-2)79-92-94(88,89)91-77-76-84-81(85)73-70-67-64-61-58-55-52-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25,27-28,32,34,36-37,52,80H,4-6,8-9,11-15,17,20,22-24,26,29-31,33,35,38-51,53-79H2,1-3H3,(H,84,85)(H,88,89)/p-1/b10-7-,19-16-,21-18-,28-25-,34-32-,37-36-,52-27-/t80-/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)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C83H150NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-36-37-38-39-40-41-42-43-44-45-47-48-50-53-56-59-62-65-68-71-74-82(86)90-78-80(93-83(87)75-72-69-66-63-60-57-54-51-49-46-33-31-29-26-23-20-17-14-11-8-5-2)79-92-94(88,89)91-77-76-84-81(85)73-70-67-64-61-58-55-52-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25,27-28,32,34,36-37,52,80H,4-6,8-9,11-15,17,20,22-24,26,29-31,33,35,38-51,53-79H2,1-3H3,(H,84,85)(H,88,89)/b10-7-,19-16-,21-18-,28-25-,34-32-,37-36-,52-27-/t80-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:35]/[CH:36]=[CH:37]\[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:47][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][CH2:74][C:82](=[O:86])[O:90][CH2:78][C@H:80]([CH2:79][O:92][P:94]([OH:88])(=[O:89])[O:91][CH2:77][CH2:76][N:84]=[C:81]([CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55]/[CH:52]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:85])[O:93][C:83]([CH2:75][CH2:72][CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:49][CH2:46][CH2:33][CH2:31][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:87] |
|