(Q104923228)

English

(2R,3S,4S)-2-(4-hydroxy-3-methoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolane-2,4-diol

chemical compound

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instance of

type of chemical entity

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subclass of

2-(4-hydroxy-3-methoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolane-2,4-diol

1 reference

based on heuristic

inferred from SMILES

mass

392.147117728 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₄O₈

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canonical SMILES

OC1=CC=C(C=C1OC)CC2(O)COC(O)(C3=CC=C(O)C(OC)=C3)C2CO

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isomeric SMILES

COc1cc(C[C@@]2(O)CO[C@@](O)(c3ccc(O)c(OC)c3)[C@H]2CO)ccc1O

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found in taxon

Carduus vivariensis

1 reference

stated in

Lignans and flavonoids from Carduus assoi

Carduus nigrescens

1 reference

stated in

Lignans and flavonoids from Carduus assoi

Identifiers

InChI

InChI=1S/C20H24O8/c1-26-16-7-12(3-5-14(16)22)9-19(24)11-28-20(25,18(19)10-21)13-4-6-15(23)17(8-13)27-2/h3-8,18,21-25H,9-11H2,1-2H3/t18-,19+,20-/m0/s1

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InChIKey

BCDMAKZFWCATFJ-ZCNNSNEGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BCDMAKZFWCATFJ-ZCNNSNEGSA-N

(Q104923228)

(2R,3S,4S)-2-(4-hydroxy-3-methoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolane-2,4-diol

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