| Properties | Image |
|---|
| MNX_ID | MNXM105138 |
 |
| reference | chebi:69131 |
| formula | C30H40O8 |
| global charge | 0 |
| mol weight | 528.642 |
| InChIKey | CVVBJPYJIWDRMQ-FVRSRKCVSA-N |
| InChI | InChI=1S/C30H40O8/c1-18-12-19(2)15-24(31)30(34)27-17-26(25(37-27)11-10-23-14-20(3)16-29(33)36-23)38-28(32)9-5-7-21-6-4-8-22(13-18)35-21/h4-6,9-11,16,18,21-27,30-31,34H,2,7-8,12-15,17H2,1,3H3/b9-5-,11-10+/t18-,21-,22-,23+,24-,25-,26-,27+,30-/m0/s1 |
| SMILES | C=C1C[C@H](C)C[C@@H]2CC=C[C@@H](C/C=C\C(=O)O[C@H]3C[C@@H](O[C@H]3/C=C/[C@@H]3CC(C)=CC(=O)O3)[C@@H](O)[C@@H](O)C1)O2 |
MNX internals
| InChI (mnx) | InChI=1/C30H40O8/c1-18-12-19(2)15-24(31)30(34)27-17-26(25(37-27)11-10-23-14-20(3)16-29(33)36-23)38-28(32)9-5-7-21-6-4-8-22(13-18)35-21/h4-6,9-11,16,18,21-27,30-31,34H,2,7-8,12-15,17H2,1,3H3/b9-5-,11-10+/t18-,21-,22-,23+,24-,25-,26-,27+,30-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@H:18]1[CH2:12][C:19](=[CH2:2])[CH2:15][C@H:24]([OH:31])[C@H:30]([OH:34])[C@H:27]2[CH2:17][C@@H:26]([C@H:25](/[CH:11]=[CH:10]/[C@@H:23]3[CH2:14][C:20]([CH3:3])=[CH:16][C:29](=[O:33])[O:36]3)[O:37]2)[O:38][C:28](=[O:32])/[CH:9]=[CH:5]\[CH2:7][C@@H:21]2[CH:6]=[CH:4][CH2:8][C@@H:22]([CH2:13]1)[O:35]2 |
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