| Properties | Image |
|---|
| MNX_ID | MNXM1181375 |
 |
| reference | envipathM:...46aaeede5d7a |
| formula | C54H90O11 |
| global charge | 0 |
| mol weight | 915.303 |
| InChIKey | NKCJJYPRUSJLNY-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H90O11/c1-4-7-10-12-13-14-15-16-17-18-19-22-27-34-45(56)54(59)62-43(42-61-53(58)44(55)33-28-25-26-31-37-47-46(63-47)36-29-21-11-8-5-2)41-60-52(57)39-32-24-20-23-30-38-49-51(65-49)40-50-48(64-50)35-9-6-3/h12-13,15-16,21,29,43,45-51,56H,4-11,14,17-20,22-28,30-42H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCC(O)C(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)C(=O)CCCCCCC1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H90O11/c1-4-7-10-12-13-14-15-16-17-18-19-22-27-34-45(56)54(59)62-43(42-61-53(58)44(55)33-28-25-26-31-37-47-46(63-47)36-29-21-11-8-5-2)41-60-52(57)39-32-24-20-23-30-38-49-51(65-49)40-50-48(64-50)35-9-6-3/h12-13,15-16,21,29,43,45-51,56H,4-11,14,17-20,22-28,30-42H2,1-3H3/b13-12?,16-15?,29-21?/t43?,45?,46?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:12]=[CH:13][CH2:14][CH:15]=[CH:16][CH2:17][CH2:18][CH2:19][CH2:22][CH2:27][CH2:34][CH:45]([C:54](=[O:59])[O:62][CH:43]([CH2:41][O:60][C:52]([CH2:39][CH2:32][CH2:24][CH2:20][CH2:23][CH2:30][CH2:38][CH:49]1[CH:51]([CH2:40][CH:50]2[CH:48]([CH2:35][CH2:9][CH2:6][CH3:3])[O:64]2)[O:65]1)=[O:57])[CH2:42][O:61][C:53]([C:44]([CH2:33][CH2:28][CH2:25][CH2:26][CH2:31][CH2:37][CH:47]1[CH:46]([CH2:36][CH:29]=[CH:21][CH2:11][CH2:8][CH2:5][CH3:2])[O:63]1)=[O:55])=[O:58])[OH:56] |
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