(Q104667528)

English

(3S,4S,10R,11R,18R)-4,18-bis(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-10-(4-hydroxyphenyl)-5,9-dioxapentacyclo[9.8.1.02,6.08,20.012,17]icosa-1(20),2(6),7,12(17),13,15-hexaene-14,16-diol

chemical compound

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instance of

type of chemical entity

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subclass of

4,18-Bis(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-10-(4-hydroxyphenyl)-5,9-dioxapentacyclo[9.8.1.02,6.08,20.012,17]icosa-1(20),2(6),7,12(17),13,15-hexaene-14,16-diol

1 reference

based on heuristic

inferred from SMILES

mass

712.194461844 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₂H₃₂O₁₁

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canonical SMILES

OC1=CC=C(C=C1)C2OC=3C=C4OC(C5=CC=C(O)C=C5O)C(C=6C=C(O)C=C(O)C6)C4=C7C3C2C=8C=C(O)C=C(O)C8C(C9=CC=C(O)C=C9O)C7

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isomeric SMILES

Oc1ccc([C@@H]2Oc3cc4c(c5c3[C@H]2c2cc(O)cc(O)c2[C@@H](c2ccc(O)cc2O)C5)[C@H](c2cc(O)cc(O)c2)[C@@H](c2ccc(O)cc2O)O4)cc1

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found in taxon

Gnetum gnemon

1 reference

stated in

Five Stilbene Glucosides from Gnetum gnemonoides and Gnetum africanum

Identifiers

InChI

InChI=1S/C42H32O11/c43-20-3-1-18(2-4-20)41-40-29-12-25(48)15-33(51)37(29)28(26-7-5-21(44)13-31(26)49)16-30-38-34(17-35(52-41)39(30)40)53-42(27-8-6-22(45)14-32(27)50)36(38)19-9-23(46)11-24(47)10-19/h1-15,17,28,36,40-51H,16H2/t28-,36+,40-,41+,42-/m1/s1

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InChIKey

BSDPTOWSJIJJPY-JGKLALJQSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104667528)

(3S,4S,10R,11R,18R)-4,18-bis(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-10-(4-hydroxyphenyl)-5,9-dioxapentacyclo[9.8.1.02,6.08,20.012,17]icosa-1(20),2(6),7,12(17),13,15-hexaene-14,16-diol

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