| Properties | Image |
|---|
| MNX_ID | MNXM105572 |
 |
| reference | chebi:70341 |
| formula | C30H46O9 |
| global charge | 0 |
| mol weight | 550.689 |
| InChIKey | FIWJCKNZIXFBGP-DKGYTLFJSA-N |
| InChI | InChI=1S/C30H46O9/c1-8-10-25(33)37-22(9-2)29(34)39-24-14-21(32)17(4)13-23-26-16(3)11-12-20(18(5)15-36-19(6)31)27(26)28(38-23)30(24,7)35/h18,20-24,26-28,32,35H,3-4,8-15H2,1-2,5-7H3/t18-,20+,21-,22?,23+,24-,26+,27+,28+,30+/m0/s1 |
| SMILES | C=C1CC[C@H]([C@@H](C)COC(C)=O)[C@@H]2[C@H]1[C@H]1CC(=C)[C@@H](O)C[C@H](OC(=O)C(CC)OC(=O)CCC)[C@@](C)(O)[C@@H]2O1 |
MNX internals
| InChI (mnx) | InChI=1/C30H46O9/c1-8-10-25(33)37-22(9-2)29(34)39-24-14-21(32)17(4)13-23-26-16(3)11-12-20(18(5)15-36-19(6)31)27(26)28(38-23)30(24,7)35/h18,20-24,26-28,32,35H,3-4,8-15H2,1-2,5-7H3/t18-,20+,21-,22?,23+,24-,26+,27+,28+,30+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:8][CH2:10][C:25](=[O:33])[O:37][CH:22]([CH2:9][CH3:2])[C:29](=[O:34])[O:39][C@H:24]1[CH2:14][C@H:21]([OH:32])[C:17](=[CH2:4])[CH2:13][C@@H:23]2[C@H:26]3[C:16](=[CH2:3])[CH2:11][CH2:12][C@H:20]([C@@H:18]([CH3:5])[CH2:15][O:36][C:19]([CH3:6])=[O:31])[C@H:27]3[C@H:28]([C@:30]1([CH3:7])[OH:35])[O:38]2 |
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