(Q105180358)

English

[6,7,8,11,12,13,22-Heptahydroxy-21-(hydroxymethyl)-3,16-dioxo-2,17,20-trioxatetracyclo[16.3.1.04,9.010,15]docosa-4,6,8,10,12,14-hexaen-19-yl] 3,4,5-trihydroxybenzoate

group of stereoisomers with the chemical formula C₂₇H₂₂O₁₈

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

634.080613864 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₂₂O₁₈

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canonical SMILES

O=C(OC1OC(CO)C2OC(=O)C3=CC(O)=C(O)C(O)=C3C=4C(O)=C(O)C(O)=CC4C(=O)OC1C2O)C5=CC(O)=C(O)C(O)=C5

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found in taxon

Phyllanthus emblica

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stated in

Novel norsesquiterpenoids from the roots of Phyllanthus emblica

Identifiers

InChI

InChI=1S/C27H22O18/c28-5-13-22-21(38)23(27(42-13)45-24(39)6-1-9(29)16(33)10(30)2-6)44-26(41)8-4-12(32)18(35)20(37)15(8)14-7(25(40)43-22)3-11(31)17(34)19(14)36/h1-4,13,21-23,27-38H,5H2

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InChIKey

NJXCTOMVEYVVGG-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NJXCTOMVEYVVGG-UHFFFAOYSA-N

(Q105180358)

[6,7,8,11,12,13,22-Heptahydroxy-21-(hydroxymethyl)-3,16-dioxo-2,17,20-trioxatetracyclo[16.3.1.04,9.010,15]docosa-4,6,8,10,12,14-hexaen-19-yl] 3,4,5-trihydroxybenzoate

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Identifiers

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