| Properties | Image |
|---|
| MNX_ID | MNXM109137 |
 |
| reference | chebi:66185 |
| formula | C28H34O10 |
| global charge | 0 |
| mol weight | 530.57 |
| InChIKey | CAOGJIYLLPIVFO-BOPFTXTBSA-N |
| InChI | InChI=1S/C28H34O10/c1-6-7-8-9-20(29)38-23-16(3)15(2)10-17(11-21(30)33-4)28(26(31)27(32)34-5)13-35-25-22(28)18(23)12-19-24(25)37-14-36-19/h11-12,15-16,23H,6-10,13-14H2,1-5H3/b17-11- |
| SMILES | CCCCCC(=O)OC1C2=C3C(=C4OCOC4=C2)OCC3(C(=O)C(=O)OC)/C(=C\C(=O)OC)CC(C)C1C |
MNX internals
| InChI (mnx) | InChI=1/C28H34O10/c1-6-7-8-9-20(29)38-23-16(3)15(2)10-17(11-21(30)33-4)28(26(31)27(32)34-5)13-35-25-22(28)18(23)12-19-24(25)37-14-36-19/h11-12,15-16,23H,6-10,13-14H2,1-5H3/b17-11-/t15?,16?,23?,28? |
 |
| SMILES (mnx) | [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][C:20](=[O:29])[O:38][CH:23]1[CH:16]([CH3:3])[CH:15]([CH3:2])[CH2:10]/[C:17](=[CH:11]/[C:21](=[O:30])[O:33][CH3:4])[C:28]2([C:26]([C:27](=[O:32])[O:34][CH3:5])=[O:31])[CH2:13][O:35][C:25]3=[C:24]4[C:19](=[CH:12][C:18]1=[C:22]32)[O:36][CH2:14][O:37]4 |
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