| Properties | Image |
|---|
| MNX_ID | MNXM1192287 |
 |
| reference | envipathM:...dd166069a550 |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | KYPUKXOPSFWSNP-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-3-5-7-9-10-14-21-29-43(56)30-22-19-20-28-36-54(60)63-45(41-61-52(58)34-26-17-11-15-24-32-47-46(64-47)31-23-13-8-6-4-2)42-62-53(59)35-27-18-12-16-25-33-48-50(65-48)39-51-49(66-51)38-37-44(57)40-55/h9-10,13,23,44-51,55,57H,3-8,11-12,14-22,24-42H2,1-2H3 |
| SMILES | CCCCC=CCCCC(=O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC=CCCCC)COC(=O)CCCCCCCC1OC1CC1OC1CCC(O)CO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-3-5-7-9-10-14-21-29-43(56)30-22-19-20-28-36-54(60)63-45(41-61-52(58)34-26-17-11-15-24-32-47-46(64-47)31-23-13-8-6-4-2)42-62-53(59)35-27-18-12-16-25-33-48-50(65-48)39-51-49(66-51)38-37-44(57)40-55/h9-10,13,23,44-51,55,57H,3-8,11-12,14-22,24-42H2,1-2H3/b10-9?,23-13?/t44?,45?,46?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:14][CH2:21][CH2:29][C:43]([CH2:30][CH2:22][CH2:19][CH2:20][CH2:28][CH2:36][C:54](=[O:60])[O:63][CH:45]([CH2:41][O:61][C:52]([CH2:34][CH2:26][CH2:17][CH2:11][CH2:15][CH2:24][CH2:32][CH:47]1[CH:46]([CH2:31][CH:23]=[CH:13][CH2:8][CH2:6][CH2:4][CH3:2])[O:64]1)=[O:58])[CH2:42][O:62][C:53]([CH2:35][CH2:27][CH2:18][CH2:12][CH2:16][CH2:25][CH2:33][CH:48]1[CH:50]([CH2:39][CH:51]2[CH:49]([CH2:38][CH2:37][CH:44]([CH2:40][OH:55])[OH:57])[O:66]2)[O:65]1)=[O:59])=[O:56] |
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