| Properties | Image |
MNX_ID | MNXM324986 |
 |
reference | slm:000251639 |
formula | C65H114O6 |
global charge | 0 |
mol weight | 991.621 |
InChIKey | YPLHTZKSDGVSAD-FNULDODXSA-N |
InChI | InChI=1S/C65H114O6/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-35-36-38-41-44-47-50-53-56-59-65(68)71-62(60-69-63(66)57-54-51-48-45-42-39-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-37-26-23-20-17-14-11-8-5-2/h8,11-12,15,17,20-21,24,26,37,43,46,62H,4-7,9-10,13-14,16,18-19,22-23,25,27-36,38-42,44-45,47-61H2,1-3H3/b11-8-,15-12-,20-17-,24-21-,37-26-,46-43-/t62-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C65H114O6/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-35-36-38-41-44-47-50-53-56-59-65(68)71-62(60-69-63(66)57-54-51-48-45-42-39-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-37-26-23-20-17-14-11-8-5-2/h8,11-12,15,17,20-21,24,26,37,43,46,62H,4-7,9-10,13-14,16,18-19,22-23,25,27-36,38-42,44-45,47-61H2,1-3H3/b11-8-,15-12-,20-17-,24-21-,37-26-,46-43-/t62-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][C:65](=[O:68])[O:71][C@H:62]([CH2:60][O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39]/[CH:24]=[CH:21]\[CH2:18]/[CH:15]=[CH:12]\[CH2:9][CH2:6][CH3:3])=[O:66])[CH2:61][O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:43]\[CH2:40]/[CH:37]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:67] |
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