| Properties | Image |
|---|
| MNX_ID | MNXM961553 |
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| reference | slm:000653938 |
| formula | C63H103NO9P |
| global charge | -1 |
| mol weight | 1049.489 |
| InChIKey | XMVSVKUQKZNFRZ-BXRJAFAGSA-M |
| InChI | InChI=1S/C63H104NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-29-30-31-33-35-37-39-41-43-45-47-49-52-55-63(67)73-60(59-72-74(68,69)71-57-56-64-61(65)53-50-9-6-3)58-70-62(66)54-51-48-46-44-42-40-38-36-34-32-27-25-23-21-19-17-15-13-11-8-5-2/h7,10,14-17,20-23,26-28,30-32,35-38,60H,4-6,8-9,11-13,18-19,24-25,29,33-34,39-59H2,1-3H3,(H,64,65)(H,68,69)/p-1/b10-7-,16-14-,17-15-,22-20-,23-21-,28-26-,31-30-,32-27-,37-35-,38-36-/t60-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H104NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-29-30-31-33-35-37-39-41-43-45-47-49-52-55-63(67)73-60(59-72-74(68,69)71-57-56-64-61(65)53-50-9-6-3)58-70-62(66)54-51-48-46-44-42-40-38-36-34-32-27-25-23-21-19-17-15-13-11-8-5-2/h7,10,14-17,20-23,26-28,30-32,35-38,60H,4-6,8-9,11-13,18-19,24-25,29,33-34,39-59H2,1-3H3,(H,64,65)(H,68,69)/b10-7-,16-14-,17-15-,22-20-,23-21-,28-26-,31-30-,32-27-,37-35-,38-36-/t60-/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]\[CH2:29]/[CH:30]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][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][CH2:46][CH2:44][CH2:42][CH2:40]/[CH:38]=[CH:36]\[CH2:34]/[CH:32]=[CH:27]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][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][CH2:9][CH2:6][CH3:3])[OH:65] |
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