| Properties | Image |
|---|
| MNX_ID | MNXM103544 |
 |
| reference | chebi:65586 |
| formula | C29H42O8 |
| global charge | 0 |
| mol weight | 518.647 |
| InChIKey | FGGPIWICAGRSLN-WZBIUJGPSA-N |
| InChI | InChI=1S/C29H42O8/c1-9-16(3)11-12-28(8)18(5)13-24(32)29-22(26(34-19(6)30)37-27(29)35-20(7)31)14-21(15-23(28)29)36-25(33)17(4)10-2/h9,11,14,17-18,21,23-24,26-27,32H,1,10,12-13,15H2,2-8H3/b16-11+/t17?,18-,21-,23+,24+,26+,27-,28-,29-/m0/s1 |
| SMILES | C=C/C(C)=C/C[C@]1(C)[C@H]2C[C@@H](OC(=O)C(C)CC)C=C3[C@H](OC(C)=O)O[C@H](OC(C)=O)[C@@]32[C@H](O)C[C@@H]1C |
MNX internals
| InChI (mnx) | InChI=1/C29H42O8/c1-9-16(3)11-12-28(8)18(5)13-24(32)29-22(26(34-19(6)30)37-27(29)35-20(7)31)14-21(15-23(28)29)36-25(33)17(4)10-2/h9,11,14,17-18,21,23-24,26-27,32H,1,10,12-13,15H2,2-8H3/b16-11+/t17?,18-,21-,23+,24+,26+,27-,28-,29-/m0/s1 |
 |
| SMILES (mnx) | [CH2:1]=[CH:9]/[C:16]([CH3:3])=[CH:11]/[CH2:12][C@@:28]1([CH3:8])[C@@H:18]([CH3:5])[CH2:13][C@@H:24]([OH:32])[C@:29]23[C:22](=[CH:14][C@H:21]([O:36][C:25]([CH:17]([CH3:4])[CH2:10][CH3:2])=[O:33])[CH2:15][C@H:23]12)[C@H:26]([O:34][C:19]([CH3:6])=[O:30])[O:37][C@@H:27]3[O:35][C:20]([CH3:7])=[O:31] |
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