(Q110081641)

English

[5-Hydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-3-yl]oxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₄₂H₄₆O₂₃

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

918.242987732 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₂H₄₆O₂₃

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canonical SMILES

O=C(OC1C(OC=2C(=O)C3=C(O)C=C(OC4OC(C)C(O)C(O)C4O)C=C3OC2C=5C=CC(O)=CC5)OC(CO)C(O)C1OC6OC(CO)C(O)C(O)C6O)C=CC7=CC=C(O)C(O)=C7

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found in taxon

Asplenium scolopendrium

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stated in

Kaempferol Glycosides in Asplenium scolopendvium Newm

Identifiers

InChI

InChI=1S/C42H46O23/c1-15-28(50)32(54)34(56)40(58-15)59-19-11-22(48)27-23(12-19)60-36(17-4-6-18(45)7-5-17)38(31(27)53)65-42-39(63-26(49)9-3-16-2-8-20(46)21(47)10-16)37(30(52)25(14-44)62-42)64-41-35(57)33(55)29(51)24(13-43)61-41/h2-12,15,24-25,28-30,32-35,37,39-48,50-52,54-57H,13-14H2,1H3

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InChIKey

MKEHIHDELIMSAJ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MKEHIHDELIMSAJ-UHFFFAOYSA-N

(Q110081641)

[5-Hydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-3-yl]oxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate

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Identifiers

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