(Q104947411)

English

(3R,4S)-4-[[3-[(1S,2R)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

554.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,4R)-4-[[3-[(1R,2R)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

1 reference

based on heuristic

inferred from InChI

(3R,4R)-4-[[3-[(1S,2R)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₃₄O₁₀

0 references

canonical SMILES

O=C1OCC(CC2=CC(OC)=C(O)C(=C2)C(CO)C(O)C3=CC=C(O)C(OC)=C3)C1CC4=CC=C(O)C(OC)=C4

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isomeric SMILES

COc1cc(C[C@H]2C(=O)OC[C@H]2Cc2cc(OC)c(O)c([C@H](CO)[C@H](O)c3ccc(O)c(OC)c3)c2)ccc1O

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found in taxon

Arctium lappa

1 reference

stated in

New sesquilignans from Arctium lappa L. The structure of lappaol C, D and E.

Identifiers

InChI

InChI=1S/C30H34O10/c1-37-25-11-16(4-6-23(25)32)9-20-19(15-40-30(20)36)8-17-10-21(29(35)27(12-17)39-3)22(14-31)28(34)18-5-7-24(33)26(13-18)38-2/h4-7,10-13,19-20,22,28,31-35H,8-9,14-15H2,1-3H3/t19-,20-,22+,28-/m1/s1

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InChIKey

BWOAMGHNXHLWMX-VLSDACPESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BWOAMGHNXHLWMX-VLSDACPESA-N

(Q104947411)

(3R,4S)-4-[[3-[(1S,2R)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

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Identifiers

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