| Properties | Image |
|---|
| MNX_ID | MNXM960252 |
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| reference | slm:000652637 |
| formula | C63H105NO9P |
| global charge | -1 |
| mol weight | 1051.505 |
| InChIKey | IXBCLTNJEFFNKU-FBARJREESA-M |
| InChI | InChI=1S/C63H106NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-29-30-31-32-34-36-38-40-42-44-46-49-52-55-63(67)73-60(59-72-74(68,69)71-57-56-64-61(65)53-50-47-12-9-6-3)58-70-62(66)54-51-48-45-43-41-39-37-35-33-26-24-22-20-18-16-14-11-8-5-2/h7,10,15-18,21-24,27-28,30-31,33,35,39,41,60H,4-6,8-9,11-14,19-20,25-26,29,32,34,36-38,40,42-59H2,1-3H3,(H,64,65)(H,68,69)/p-1/b10-7-,17-15-,18-16-,23-21-,24-22-,28-27-,31-30-,35-33-,41-39-/t60-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H106NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-29-30-31-32-34-36-38-40-42-44-46-49-52-55-63(67)73-60(59-72-74(68,69)71-57-56-64-61(65)53-50-47-12-9-6-3)58-70-62(66)54-51-48-45-43-41-39-37-35-33-26-24-22-20-18-16-14-11-8-5-2/h7,10,15-18,21-24,27-28,30-31,33,35,39,41,60H,4-6,8-9,11-14,19-20,25-26,29,32,34,36-38,40,42-59H2,1-3H3,(H,64,65)(H,68,69)/b10-7-,17-15-,18-16-,23-21-,24-22-,28-27-,31-30-,35-33-,41-39-/t60-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:49][CH2:52][CH2:55][C:63](=[O:67])[O:73][C@H:60]([CH2:58][O:70][C:62]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:43]/[CH:41]=[CH:39]\[CH2:37]/[CH:35]=[CH:33]\[CH2:26]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66])[CH2:59][O:72][P:74]([OH:68])(=[O:69])[O:71][CH2:57][CH2:56][N:64]=[C:61]([CH2:53][CH2:50][CH2:47][CH2:12][CH2:9][CH2:6][CH3:3])[OH:65] |
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