| Properties | Image |
MNX_ID | MNXM959679 |
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reference | slm:000652064 |
formula | C59H105NO9P |
global charge | -1 |
mol weight | 1003.461 |
InChIKey | QIOZGNSICKPKMR-UKJJNUIXSA-M |
InChI | InChI=1S/C59H106NO9P/c1-4-7-10-13-16-18-20-22-24-26-27-28-29-31-33-35-37-39-42-45-48-51-59(63)69-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-40-15-12-9-6-3)54-66-58(62)50-47-44-41-38-36-34-32-30-25-23-21-19-17-14-11-8-5-2/h17,19,22-25,32,34,38,41,56H,4-16,18,20-21,26-31,33,35-37,39-40,42-55H2,1-3H3,(H,60,61)(H,64,65)/p-1/b19-17-,24-22-,25-23-,34-32-,41-38-/t56-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C59H106NO9P/c1-4-7-10-13-16-18-20-22-24-26-27-28-29-31-33-35-37-39-42-45-48-51-59(63)69-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-40-15-12-9-6-3)54-66-58(62)50-47-44-41-38-36-34-32-30-25-23-21-19-17-14-11-8-5-2/h17,19,22-25,32,34,38,41,56H,4-16,18,20-21,26-31,33,35-37,39-40,42-55H2,1-3H3,(H,60,61)(H,64,65)/b19-17-,24-22-,25-23-,34-32-,41-38-/t56-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:18][CH2:20]/[CH:22]=[CH:24]\[CH2:26][CH2:27][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][C:59](=[O:63])[O:69][C@H:56]([CH2:54][O:66][C:58]([CH2:50][CH2:47][CH2:44]/[CH:41]=[CH:38]\[CH2:36]/[CH:34]=[CH:32]\[CH2:30]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62])[CH2:55][O:68][P:70]([OH:64])(=[O:65])[O:67][CH2:53][CH2:52][N:60]=[C:57]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:61] |
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