| Properties | Image |
MNX_ID | MNXM939139 |
 |
reference | slm:000631524 |
formula | C83H143NO9P |
global charge | -1 |
mol weight | 1330.029 |
InChIKey | FJZVQMLBKVSALM-KQQFYNMJSA-M |
InChI | InChI=1S/C83H144NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-48-50-52-54-56-58-60-62-64-66-68-71-74-82(86)90-78-80(79-92-94(88,89)91-77-76-84-81(85)73-70-9-6-3)93-83(87)75-72-69-67-65-63-61-59-57-55-53-51-49-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-35,80H,4-6,9,12-13,18-19,24-25,30-31,36-79H2,1-3H3,(H,84,85)(H,88,89)/p-1/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,35-33-/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)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/C83H144NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-48-50-52-54-56-58-60-62-64-66-68-71-74-82(86)90-78-80(79-92-94(88,89)91-77-76-84-81(85)73-70-9-6-3)93-83(87)75-72-69-67-65-63-61-59-57-55-53-51-49-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-35,80H,4-6,9,12-13,18-19,24-25,30-31,36-79H2,1-3H3,(H,84,85)(H,88,89)/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,35-33-/t80-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:62][CH2:64][CH2:66][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][CH2:9][CH2:6][CH3:3])[OH:85])[O:93][C:83]([CH2:75][CH2:72][CH2:69][CH2:67][CH2:65][CH2:63][CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:29]=[CH:27]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:87] |
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