| Properties | Image |
|---|
| MNX_ID | MNXM1178765 |
 |
| reference | envipathM:...c1c799f48f22 |
| formula | C54H98O13 |
| global charge | 0 |
| mol weight | 955.365 |
| InChIKey | IWJSABVMBNOOJS-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H98O13/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-50(59)66-43(42-65-49(58)39-32-27-21-24-30-37-47-46(67-47)36-29-22-10-8-5-2)41-64-48(57)38-31-26-20-23-28-35-45(56)52(61)54(63)53(62)51(60)44(55)34-6-3/h11-12,14-15,43-47,51-56,60-63H,4-10,13,16-42H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC(O)C(O)C(O)C(O)C(O)C(O)CCC)COC(=O)CCCCCCCC1OC1CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H98O13/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-50(59)66-43(42-65-49(58)39-32-27-21-24-30-37-47-46(67-47)36-29-22-10-8-5-2)41-64-48(57)38-31-26-20-23-28-35-45(56)52(61)54(63)53(62)51(60)44(55)34-6-3/h11-12,14-15,43-47,51-56,60-63H,4-10,13,16-42H2,1-3H3/b12-11?,15-14?/t43?,44?,45?,46?,47?,51?,52?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH:11]=[CH:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:25][CH2:33][CH2:40][C:50](=[O:59])[O:66][CH:43]([CH2:41][O:64][C:48]([CH2:38][CH2:31][CH2:26][CH2:20][CH2:23][CH2:28][CH2:35][CH:45]([CH:52]([CH:54]([CH:53]([CH:51]([CH:44]([CH2:34][CH2:6][CH3:3])[OH:55])[OH:60])[OH:62])[OH:63])[OH:61])[OH:56])=[O:57])[CH2:42][O:65][C:49]([CH2:39][CH2:32][CH2:27][CH2:21][CH2:24][CH2:30][CH2:37][CH:47]1[CH:46]([CH2:36][CH2:29][CH2:22][CH2:10][CH2:8][CH2:5][CH3:2])[O:67]1)=[O:58] |
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