| Properties | Image |
|---|
| MNX_ID | MNXM955631 |
 |
| reference | slm:000648016 |
| formula | C51H81NO9P |
| global charge | -1 |
| mol weight | 883.181 |
| InChIKey | HOVFXQXWOPBEDZ-ZCBWJWOFSA-M |
| InChI | InChI=1S/C51H82NO9P/c1-4-7-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-40-43-51(55)61-48(47-60-62(56,57)59-45-44-52-49(53)41-38-9-6-3)46-58-50(54)42-39-36-34-32-30-28-26-21-19-17-15-13-11-8-5-2/h7,10,14-17,20-22,24-26,29-32,35,37,48H,4-6,8-9,11-13,18-19,23,27-28,33-34,36,38-47H2,1-3H3,(H,52,53)(H,56,57)/p-1/b10-7-,16-14-,17-15-,22-20-,25-24-,26-21-,31-29-,32-30-,37-35-/t48-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C51H82NO9P/c1-4-7-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-40-43-51(55)61-48(47-60-62(56,57)59-45-44-52-49(53)41-38-9-6-3)46-58-50(54)42-39-36-34-32-30-28-26-21-19-17-15-13-11-8-5-2/h7,10,14-17,20-22,24-26,29-32,35,37,48H,4-6,8-9,11-13,18-19,23,27-28,33-34,36,38-47H2,1-3H3,(H,52,53)(H,56,57)/b10-7-,16-14-,17-15-,22-20-,25-24-,26-21-,31-29-,32-30-,37-35-/t48-/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]\[CH2:23]/[CH:24]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:40][CH2:43][C:51](=[O:55])[O:61][C@H:48]([CH2:46][O:58][C:50]([CH2:42][CH2:39][CH2:36][CH2:34]/[CH:32]=[CH:30]\[CH2:28]/[CH:26]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:8][CH2:5][CH3:2])=[O:54])[CH2:47][O:60][P:62]([OH:56])(=[O:57])[O:59][CH2:45][CH2:44][N:52]=[C:49]([CH2:41][CH2:38][CH2:9][CH2:6][CH3:3])[OH:53] |
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