(Q110190401)

English

[6-[2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-2-methoxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₃₇H₃₈O₂₀

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

802.195643616 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₃₈O₂₀

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canonical SMILES

O=C(OCC1OC(OC2C(O)C(O)C(OC2OC=3C(=O)C=4C(O)=CC(O)=CC4OC3C=5C=CC(O)=C(O)C5)CO)C(O)C(O)C1O)C=CC6=CC=C(O)C=C6OC

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found in taxon

Scleromitrion diffusum

1 reference

stated in

Neuroprotective constituents from Hedyotis diffusa

Identifiers

InChI

InChI=1S/C37H38O20/c1-51-21-10-16(39)5-2-14(21)4-7-25(44)52-13-24-28(46)30(48)32(50)36(55-24)57-35-31(49)27(45)23(12-38)54-37(35)56-34-29(47)26-20(43)9-17(40)11-22(26)53-33(34)15-3-6-18(41)19(42)8-15/h2-11,23-24,27-28,30-32,35-43,45-46,48-50H,12-13H2,1H3

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InChIKey

XIGFVJKGNMGLEG-UHFFFAOYSA-N

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2 references

10 May 2023

inferred from InChIKey

matched by identifier from

InChIKey

XIGFVJKGNMGLEG-UHFFFAOYSA-N

(Q110190401)

[6-[2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-2-methoxyphenyl)prop-2-enoate

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Identifiers

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