Catalog Number
ACM802918576
Category
Heterocyclic Organic Compound
IUPAC Name
(2R,3R)-3,5,7-Trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one
Molecular Formula
C25H22O10
Canonical SMILES
COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=C(C=C3)C4C(C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O
InChI
InChI=1S/C25H22O10/c1-32-17-6-11(2-4-14(17)28)24-20(10-26)33-16-5-3-12(7-18(16)34-24)25-23(31)22(30)21-15(29)8-13(27)9-19(21)35-25/h2-9,20,23-29,31H,10H2,1H3/t20?,23-,24?,25+/m0/s1
InChI Key
SEBFKMXJBCUCAI-DBMPWETRSA-N
Isomeric SMILES
COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=C(C=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O
Monoisotopic Mass
482.12129689
Topological Polar Surface Area
155 Ų
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![2H-Furo[3,2-b]pyrrol-3(3ah)-one,4-acetyltetrahydro-,(3ar,6ar)-rel-(9ci)](https://resource.alfa-chemistry.com/structure/802919-01-3.gif)
