(Q110197985)

English

[6,7,8,11,12,13,22-Heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] 7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylate

group of stereoisomers with the chemical formula C₄₀H₂₈O₂₅

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Statements

instance of

group of stereoisomers

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subclass of

macrolides

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mass

908.091966396 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₀H₂₈O₂₅

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canonical SMILES

O=C1OC=2C(=O)CC(C(=O)OC3C4OC(OC(=O)C5=CC(O)=C(O)C(O)=C5)C(O)C3OC(=O)C6=CC(O)=C(O)C(O)=C6C=7C(O)=C(O)C(O)=CC7C(=O)OC4)C2C=8C(O)=C(O)C(O)=CC18

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found in taxon

Phyllanthus urinaria

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stated in

Antiviral tannins from two Phyllanthus species

Identifiers

InChI

InChI=1S/C40H28O25/c41-13-1-8(2-14(42)24(13)47)35(55)65-40-31(54)34-33(63-39(59)12-6-18(46)32-23(12)22-11(37(57)62-32)5-17(45)27(50)30(22)53)19(61-40)7-60-36(56)9-3-15(43)25(48)28(51)20(9)21-10(38(58)64-34)4-16(44)26(49)29(21)52/h1-5,12,19,31,33-34,40-45,47-54H,6-7H2

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InChIKey

HDSDSDSDIOSGPO-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HDSDSDSDIOSGPO-UHFFFAOYSA-N

(Q110197985)

[6,7,8,11,12,13,22-Heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] 7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylate

Statements

Identifiers

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