(Q105229183)

English

(3S)-3-[(2S)-1-[3-[bis(4-hydroxyphenyl)methyl]-2,4,6-trihydroxyphenyl]-3,3-bis(4-hydroxyphenyl)-1-oxopropan-2-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-(1-{3-[bis(4-hydroxyphenyl)methyl]-2,4,6-trihydroxyphenyl}-3,3-bis(4-hydroxyphenyl)-1-oxopropan-2-yl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

1 reference

based on heuristic

inferred from SMILES

mass

742.205026528 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₃H₃₄O₁₂

0 references

canonical SMILES

O=C1C=2C(O)=CC(O)=CC2OCC1C(C(=O)C3=C(O)C=C(O)C(=C3O)C(C4=CC=C(O)C=C4)C5=CC=C(O)C=C5)C(C6=CC=C(O)C=C6)C7=CC=C(O)C=C7

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isomeric SMILES

O=C1c2c(O)cc(O)cc2OC[C@@H]1[C@@H](C(=O)c1c(O)cc(O)c(C(c2ccc(O)cc2)c2ccc(O)cc2)c1O)C(c1ccc(O)cc1)c1ccc(O)cc1

0 references

found in taxon

Stellera chamaejasme

1 reference

stated in

Flavonoids from Stellera chamaejasme

Identifiers

InChI

InChI=1S/C43H34O12/c44-25-9-1-21(2-10-25)35(22-3-11-26(45)12-4-22)37(30-20-55-34-18-29(48)17-31(49)38(34)41(30)52)42(53)40-33(51)19-32(50)39(43(40)54)36(23-5-13-27(46)14-6-23)24-7-15-28(47)16-8-24/h1-19,30,35-37,44-51,54H,20H2/t30-,37-/m1/s1

0 references

InChIKey

QWHNAWOUXQQGRB-JOCIVYRRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QWHNAWOUXQQGRB-JOCIVYRRSA-N

(Q105229183)

(3S)-3-[(2S)-1-[3-[bis(4-hydroxyphenyl)methyl]-2,4,6-trihydroxyphenyl]-3,3-bis(4-hydroxyphenyl)-1-oxopropan-2-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

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