| Properties | Image |
|---|
| MNX_ID | MNXM102728 |
 |
| reference | chebi:67444 |
| formula | C28H34O10 |
| global charge | 0 |
| mol weight | 530.57 |
| InChIKey | OHMVGFVPDINACF-XKEUNKRLSA-N |
| InChI | InChI=1S/C28H34O10/c1-9-20(30)38-24-14(3)13(2)23(37-15(4)29)16-10-18(31-5)25(32-6)27(33-7)21(16)22-17(24)11-19-26(28(22)34-8)36-12-35-19/h10-11,13-14,23-24H,9,12H2,1-8H3/t13-,14+,23+,24+/m0/s1 |
| SMILES | CCC(=O)O[C@H]1C2=CC3=C(OCO3)C(OC)=C2C2=C(C=C(OC)C(OC)=C2OC)[C@H](OC(C)=O)[C@@H](C)[C@H]1C |
MNX internals
| InChI (mnx) | InChI=1/C28H34O10/c1-9-20(30)38-24-14(3)13(2)23(37-15(4)29)16-10-18(31-5)25(32-6)27(33-7)21(16)22-17(24)11-19-26(28(22)34-8)36-12-35-19/h10-11,13-14,23-24H,9,12H2,1-8H3/t13-,14+,23+,24+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:9][C:20](=[O:30])[O:38][C@@H:24]1[C@H:14]([CH3:3])[C@H:13]([CH3:2])[C@@H:23]([O:37][C:15]([CH3:4])=[O:29])[C:16]2=[CH:10][C:18]([O:31][CH3:5])=[C:25]([O:32][CH3:6])[C:27]([O:33][CH3:7])=[C:21]2[C:22]2=[C:17]1[CH:11]=[C:19]1[C:26](=[C:28]2[O:34][CH3:8])[O:36][CH2:12][O:35]1 |
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