Representations & DB's id
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ChEBI: |
None
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ChEMBL: |
CHEMBL2436931
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PubChem: |
73346478
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IUPAC:
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1,3,7-trihydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
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Standard InChI:
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InChI=1S/C19H18O11/c20-5-11-14(24)16(26)17(27)19(29-11)30-18-8(22)4-10-12(15(18)25)13(23)7-3-6(21)1-2-9(7)28-10/h1-4,11,14,16-17,19-22,24-27H,5H2/t11-,14-,16+,17-,19+/m1/s1
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Standard InChI Key:
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CTPSYMVKWIMJIS-GPRNFGOXSA-N
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SMILES:
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OC[C@H]1O[C@@H](Oc2c(O)cc3c(c2O)c(=O)c2c(o3)ccc(c2)O)[C@@H]([C@H]([C@@H]1O)O)O |