| Properties | Image |
|---|
| MNX_ID | MNXM960625 |
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| reference | slm:000653010 |
| formula | C75H125NO9P |
| global charge | -1 |
| mol weight | 1215.797 |
| InChIKey | SBRODTPOLLGXPF-UCOVPTIASA-M |
| InChI | InChI=1S/C75H126NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-41-43-46-49-52-55-58-61-64-67-75(79)85-72(70-82-74(78)66-63-60-57-54-51-48-45-42-40-31-29-26-23-20-17-14-11-8-5-2)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-44-27-24-21-18-15-12-9-6-3/h16-21,25-29,32-33,35-36,40,42,44,48,50-51,53,72H,4-15,22-24,30-31,34,37-39,41,43,45-47,49,52,54-71H2,1-3H3,(H,76,77)(H,80,81)/p-1/b19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,42-40-,44-27-,51-48-,53-50-/t72-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C75H126NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-41-43-46-49-52-55-58-61-64-67-75(79)85-72(70-82-74(78)66-63-60-57-54-51-48-45-42-40-31-29-26-23-20-17-14-11-8-5-2)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-44-27-24-21-18-15-12-9-6-3/h16-21,25-29,32-33,35-36,40,42,44,48,50-51,53,72H,4-15,22-24,30-31,34,37-39,41,43,45-47,49,52,54-71H2,1-3H3,(H,76,77)(H,80,81)/b19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,42-40-,44-27-,51-48-,53-50-/t72-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:33]\[CH2:34]/[CH:35]=[CH:36]\[CH2:37][CH2:38][CH2:39][CH2:41][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][C:75](=[O:79])[O:85][C@H:72]([CH2:70][O:82][C:74]([CH2:66][CH2:63][CH2:60][CH2:57][CH2:54]/[CH:51]=[CH:48]\[CH2:45]/[CH:42]=[CH:40]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:78])[CH2:71][O:84][P:86]([OH:80])(=[O:81])[O:83][CH2:69][CH2:68][N:76]=[C:73]([CH2:65][CH2:62][CH2:59][CH2:56]/[CH:53]=[CH:50]\[CH2:47]/[CH:44]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:77] |
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