| Properties | Image |
|---|
| MNX_ID | MNXM107436 |
 |
| reference | chebi:66830 |
| formula | C32H34O12 |
| global charge | 0 |
| mol weight | 610.612 |
| InChIKey | TUOQDKWZMVPMKF-FWBAFIGCSA-N |
| InChI | InChI=1S/C32H34O12/c1-17-12-23(41-27(34)19-6-9-37-14-19)26(40-18(2)33)31(5)24(42-28(35)20-7-10-38-15-20)13-22-25(32(17,31)44-30(22,3)4)43-29(36)21-8-11-39-16-21/h6-11,14-17,22-26H,12-13H2,1-5H3/t17-,22-,23+,24+,25-,26+,31-,32-/m1/s1 |
| SMILES | CC(=O)O[C@H]1[C@@H](OC(=O)C2=COC=C2)C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)C4=COC=C4)[C@]12C)[C@H]3OC(=O)C1=COC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C32H34O12/c1-17-12-23(41-27(34)19-6-9-37-14-19)26(40-18(2)33)31(5)24(42-28(35)20-7-10-38-15-20)13-22-25(32(17,31)44-30(22,3)4)43-29(36)21-8-11-39-16-21/h6-11,14-17,22-26H,12-13H2,1-5H3/t17-,22-,23+,24+,25-,26+,31-,32-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:17]1[CH2:12][C@H:23]([O:41][C:27]([C:19]2=[CH:14][O:37][CH:9]=[CH:6]2)=[O:34])[C@H:26]([O:40][C:18]([CH3:2])=[O:33])[C@@:31]2([CH3:5])[C@@H:24]([O:42][C:28]([C:20]3=[CH:15][O:38][CH:10]=[CH:7]3)=[O:35])[CH2:13][C@@H:22]3[C@@H:25]([O:43][C:29]([C:21]4=[CH:16][O:39][CH:11]=[CH:8]4)=[O:36])[C@:32]12[O:44][C:30]3([CH3:3])[CH3:4] |
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