| Properties | Image |
|---|
| MNX_ID | MNXM168869 |
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| reference | sabiorkM:23369 |
| formula | C20H16O10P2 |
| global charge | 0 |
| mol weight | 478.286 |
| InChIKey | WMDDNKROYKCDJC-UHFFFAOYSA-N |
| InChI | InChI=1S/C20H16O10P2/c21-19-17-3-1-2-4-18(17)20(28-19,13-5-9-15(10-6-13)29-31(22,23)24)14-7-11-16(12-8-14)30-32(25,26)27/h1-12H,(H2,22,23,24)(H2,25,26,27) |
| SMILES | O=C1OC(C2=CC=C(OP(=O)(O)O)C=C2)(C2=CC=C(OP(=O)(O)O)C=C2)C2=CC=CC=C12 |
MNX internals
| InChI (mnx) | InChI=1/C20H16O10P2/c21-19-17-3-1-2-4-18(17)20(28-19,13-5-9-15(10-6-13)29-31(22,23)24)14-7-11-16(12-8-14)30-32(25,26)27/h1-12H,(H2,22,23,24)(H2,25,26,27) |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:18]2[C:17](=[CH:3]1)[C:19](=[O:21])[O:28][C:20]2([C:13]1=[CH:6][CH:10]=[C:15]([O:29][P:31]([OH:22])([OH:23])=[O:24])[CH:9]=[CH:5]1)[C:14]1=[CH:8][CH:12]=[C:16]([O:30][P:32]([OH:25])([OH:26])=[O:27])[CH:11]=[CH:7]1 |
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