| Properties | Image |
|---|
| MNX_ID | MNXM102413 |
 |
| reference | chebi:67460 |
| formula | C28H42O10 |
| global charge | 0 |
| mol weight | 538.634 |
| InChIKey | GDRNWAABIDILBN-QOAKXUCVSA-N |
| InChI | InChI=1S/C28H42O10/c1-14(2)24(32)38-23-19(31)11-20-26(6,21-10-18-7-8-33-25(18)37-21)15(3)9-22(36-17(5)30)27(20,12-34-16(4)29)28(23)13-35-28/h14-15,18-23,25,31H,7-13H2,1-6H3/t15-,18-,19-,20-,21+,22+,23+,25+,26+,27+,28-/m1/s1 |
| SMILES | CC(=O)OC[C@@]12[C@@H](OC(C)=O)C[C@@H](C)[C@](C)([C@@H]3C[C@H]4CCO[C@H]4O3)[C@H]1C[C@@H](O)[C@H](OC(=O)C(C)C)[C@]21CO1 |
MNX internals
| InChI (mnx) | InChI=1/C28H42O10/c1-14(2)24(32)38-23-19(31)11-20-26(6,21-10-18-7-8-33-25(18)37-21)15(3)9-22(36-17(5)30)27(20,12-34-16(4)29)28(23)13-35-28/h14-15,18-23,25,31H,7-13H2,1-6H3/t15-,18-,19-,20-,21+,22+,23+,25+,26+,27+,28-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:14]([CH3:2])[C:24](=[O:32])[O:38][C@H:23]1[C@H:19]([OH:31])[CH2:11][C@@H:20]2[C@@:26]([CH3:6])([C@@H:21]3[CH2:10][C@H:18]4[CH2:7][CH2:8][O:33][C@H:25]4[O:37]3)[C@H:15]([CH3:3])[CH2:9][C@H:22]([O:36][C:17]([CH3:5])=[O:30])[C@@:27]2([CH2:12][O:34][C:16]([CH3:4])=[O:29])[C@@:28]12[CH2:13][O:35]2 |
|