(Q105139881)

English

[4-[(1R,2R)-1,3-dihydroxy-1-(4-hydroxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]-[(3R,4S,5R)-4-(hydroxymethyl)-5-(4-hydroxyphenyl)oxolan-3-yl]methanone

chemical compound

In more languages

Statements

type of chemical entity

0 references

[4-[1,3-Dihydroxy-1-(4-hydroxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]-[4-(hydroxymethyl)-5-(4-hydroxyphenyl)oxolan-3-yl]methanone

1 reference

based on heuristic

inferred from SMILES

510.18898254 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₀O₉

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canonical SMILES

O=C(C1=CC=C(OC(CO)C(O)C2=CC=C(O)C=C2)C(OC)=C1)C3COC(C4=CC=C(O)C=C4)C3CO

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isomeric SMILES

COc1cc(C(=O)[C@H]2CO[C@@H](c3ccc(O)cc3)[C@@H]2CO)ccc1O[C@H](CO)[C@H](O)c1ccc(O)cc1

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Broussonetia papyrifera

2 references

Antioxidant Lignans from the Fruits of Broussonetia papyrifera

Antioxidant phenolics from Broussonetia papyrifera fruits

Identifiers

InChI=1S/C28H30O9/c1-35-24-12-18(6-11-23(24)37-25(14-30)27(34)16-2-7-19(31)8-3-16)26(33)22-15-36-28(21(22)13-29)17-4-9-20(32)10-5-17/h2-12,21-22,25,27-32,34H,13-15H2,1H3/t21-,22+,25-,27-,28+/m1/s1

0 references

KECSCLSUSLVJDC-ULMRLIQISA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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