| Properties | Image |
|---|
| MNX_ID | MNXM164735 |
 |
| reference | metacycM:CPD-18246 |
| formula | C30H22O10 |
| global charge | 0 |
| mol weight | 542.496 |
| InChIKey | COGSZHAZKOLWNL-UHFFFAOYSA-N |
| InChI | InChI=1S/C30H22O10/c1-11-5-15(31)23-19(39-11)9-13-7-17(37-3)25(29(35)21(13)27(23)33)26-18(38-4)8-14-10-20-24(16(32)6-12(2)40-20)28(34)22(14)30(26)36/h5-10,33-36H,1-4H3 |
| SMILES | COC1=CC2=CC3=C(C(=O)C=C(C)O3)C(O)=C2C(O)=C1C1=C(O)C2=C(O)C3=C(C=C2C=C1OC)OC(C)=CC3=O |
MNX internals
| InChI (mnx) | InChI=1/C30H22O10/c1-11-5-15(31)23-19(39-11)9-13-7-17(37-3)25(29(35)21(13)27(23)33)26-18(38-4)8-14-10-20-24(16(32)6-12(2)40-20)28(34)22(14)30(26)36/h5-10,33-36H,1-4H3 |
 |
| SMILES (mnx) | [CH3:1][C:11]1=[CH:5][C:15](=[O:31])[C:23]2=[C:19]([CH:9]=[C:13]3[CH:7]=[C:17]([O:37][CH3:3])[C:25]([C:26]4=[C:30]([OH:36])[C:22]5=[C:28]([OH:34])[C:24]6=[C:20]([CH:10]=[C:14]5[CH:8]=[C:18]4[O:38][CH3:4])[O:40][C:12]([CH3:2])=[CH:6][C:16]6=[O:32])=[C:29]([OH:35])[C:21]3=[C:27]2[OH:33])[O:39]1 |
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