(Q105381605)

English

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-1-[2-hydroxy-6-[(4-hydroxyphenyl)methoxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1-oxopropan-2-yl]chromen-4-one

chemical compound

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type of chemical entity

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subclass of

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-8-[1-[2-hydroxy-6-[(4-hydroxyphenyl)methoxy]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1-oxopropan-2-yl]chromen-4-one

1 reference

based on heuristic

inferred from SMILES

mass

734.184685008 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₃₄O₁₆

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canonical SMILES

O=C1C=C(OC=2C1=C(O)C=C(O)C2C(C(=O)C3=C(O)C=C(OC4OC(CO)C(O)C(O)C4O)C=C3OCC5=CC=C(O)C=C5)C)C=6C=CC(O)=C(O)C6

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isomeric SMILES

C[C@H](C(=O)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1OCc1ccc(O)cc1)c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc12

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found in taxon

Garcinia gardneriana

1 reference

stated in

Antibacterial and brine shrimp lethality tests of biflavonoids and derivatives of Rheedia gardneriana

Identifiers

InChI

InChI=1S/C37H34O16/c1-15(29-23(43)11-24(44)30-25(45)12-26(52-36(29)30)17-4-7-20(40)21(41)8-17)32(46)31-22(42)9-19(10-27(31)50-14-16-2-5-18(39)6-3-16)51-37-35(49)34(48)33(47)28(13-38)53-37/h2-12,15,28,33-35,37-44,47-49H,13-14H2,1H3/t15-,28+,33+,34-,35+,37+/m0/s1

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InChIKey

ZQOQOBIMSHICAM-HWPRUJKOSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105381605)

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-1-[2-hydroxy-6-[(4-hydroxyphenyl)methoxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1-oxopropan-2-yl]chromen-4-one

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