| Properties | Image |
|---|
| MNX_ID | MNXM1171000 |
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| reference | envipathM:...12d432ec2597 |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | CXUBYIMSJZCTLZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-53(60)63-44(43-62-52(59)39-32-27-21-24-30-37-49-48(64-49)36-29-22-10-8-5-2)42-61-51(58)38-31-26-20-23-28-35-45(55)47(57)41-50-54(65-50)46(56)34-6-3/h14-15,22,29,44,46,48-50,54,56H,4-13,16-21,23-28,30-43H2,1-3H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC(=O)C(=O)CC1OC1C(O)CCC)OC(=O)CCCCCCCC=CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-53(60)63-44(43-62-52(59)39-32-27-21-24-30-37-49-48(64-49)36-29-22-10-8-5-2)42-61-51(58)38-31-26-20-23-28-35-45(55)47(57)41-50-54(65-50)46(56)34-6-3/h14-15,22,29,44,46,48-50,54,56H,4-13,16-21,23-28,30-43H2,1-3H3/b15-14?,29-22?/t44?,46?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH2:11][CH2:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:25][CH2:33][CH2:40][C:53](=[O:60])[O:63][CH:44]([CH2:42][O:61][C:51]([CH2:38][CH2:31][CH2:26][CH2:20][CH2:23][CH2:28][CH2:35][C:45]([C:47]([CH2:41][CH:50]1[CH:54]([CH:46]([CH2:34][CH2:6][CH3:3])[OH:56])[O:65]1)=[O:57])=[O:55])=[O:58])[CH2:43][O:62][C:52]([CH2:39][CH2:32][CH2:27][CH2:21][CH2:24][CH2:30][CH2:37][CH:49]1[CH:48]([CH2:36][CH:29]=[CH:22][CH2:10][CH2:8][CH2:5][CH3:2])[O:64]1)=[O:59] |
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