(Q104400513)

English

(1R,2R,3S,4S,10R,11R)-4-(3,5-dihydroxyphenyl)-3,11-bis(4-hydroxyphenyl)hexacyclo[8.7.6.12,5.012,17.018,23.09,24]tetracosa-5(24),6,8,12(17),13,15,18(23),19,21-nonaene-6,8,14,19,21-pentol

chemical compound

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instance of

type of chemical entity

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subclass of

4-(3,5-Dihydroxyphenyl)-3,11-bis(4-hydroxyphenyl)hexacyclo[8.7.6.12,5.012,17.018,23.09,24]tetracosa-5(24),6,8,12(17),13,15,18(23),19,21-nonaene-6,8,14,19,21-pentol

1 reference

based on heuristic

inferred from SMILES

mass

680.204632604 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,2R,3R,4R,10R,11R)-4-(3,5-dihydroxyphenyl)-3,11-bis(4-hydroxyphenyl)hexacyclo[8.7.6.12,5.012,17.018,23.09,24]tetracosa-5(24),6,8,12(17),13,15,18(23),19,21-nonaene-6,8,14,19,21-pentol

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,2S,3R,4R,10S,11S)-4-(3,5-dihydroxyphenyl)-3,11-bis(4-hydroxyphenyl)hexacyclo[8.7.6.12,5.012,17.018,23.09,24]tetracosa-5(24),6,8,12(17),13,15,18(23),19,21-nonaene-6,8,14,19,21-pentol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₂H₃₂O₉

0 references

canonical SMILES

OC1=CC=C(C=C1)C2C3=CC(O)=CC=C3C4C=5C(O)=CC(O)=CC5C2C6=C(O)C=C(O)C7=C6C4C(C8=CC=C(O)C=C8)C7C=9C=C(O)C=C(O)C9

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isomeric SMILES

Oc1ccc([C@@H]2[C@@H](c3cc(O)cc(O)c3)c3c(O)cc(O)c4c3[C@H]2[C@@H]2c3ccc(O)cc3[C@@H](c3ccc(O)cc3)[C@@H]4c3cc(O)cc(O)c32)cc1

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found in taxon

Cotylelobium melanoxylon

1 reference

stated in

Antidiabetogenic constituents from the Thai traditional medicine Cotylelobium melanoxylon.

Vatica

1 reference

stated in

New resveratrol oligomers in the stem bark of Vatica pauciflora

Vatica rassak

1 reference

stated in

A novel bridged stilbenoid trimer and four highly condensed stilbenoid oligomers in Vatica rassak

Identifiers

InChI

InChI=1S/C42H32O9/c43-21-5-1-18(2-6-21)33-28-14-23(45)9-10-27(28)37-36-29(15-26(48)16-30(36)49)38(33)40-32(51)17-31(50)39-35(20-11-24(46)13-25(47)12-20)34(41(37)42(39)40)19-3-7-22(44)8-4-19/h1-17,33-35,37-38,41,43-51H/t33-,34-,35-,37-,38+,41-/m1/s1

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InChIKey

FWPQMKZSFDFHKZ-NMCXWCHNSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

FWPQMKZSFDFHKZ-NMCXWCHNSA-N

1 reference

(Q104400513)

(1R,2R,3S,4S,10R,11R)-4-(3,5-dihydroxyphenyl)-3,11-bis(4-hydroxyphenyl)hexacyclo[8.7.6.12,5.012,17.018,23.09,24]tetracosa-5(24),6,8,12(17),13,15,18(23),19,21-nonaene-6,8,14,19,21-pentol

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