(Q105032327)

English

(17S)-13-hydroxy-5,17-dimethoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

depsidone

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mass

400.079432092 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₁₆O₉

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canonical SMILES

O=CC1=C(OC)C=C(C=2C(=O)OC3=C(OC12)C4=C(C(=O)OC4OC)C(O)=C3C)C

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isomeric SMILES

COc1cc(C)c2c(c1C=O)Oc1c(c(C)c(O)c3c1[C@@H](OC)OC3=O)OC2=O

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found in taxon

Hypotrachyna revoluta

1 reference

stated in

Beta-orcinol metabolites from the lichen Hypotrachyna revoluta

Lobaria oregana

1 reference

stated in

New depsidones from Lobaria oregana

Parmelia verrucigera

1 reference

stated in

Lusitanic Acid, Peristictic Acid and Verrucigeric Acid. Three New β-Orcinol Depsidones from the Lichens Relicina sydneyensis and Xanthoparmelia verrucigera

Xanthoparmelia lusitana

1 reference

stated in

Lusitanic Acid, Peristictic Acid and Verrucigeric Acid. Three New β-Orcinol Depsidones from the Lichens Relicina sydneyensis and Xanthoparmelia verrucigera

Xanthoparmelia verrucigera

1 reference

stated in

Lusitanic Acid, Peristictic Acid and Verrucigeric Acid. Three New β-Orcinol Depsidones from the Lichens Relicina sydneyensis and Xanthoparmelia verrucigera

Lobaria orientalis

1 reference

stated in

Phenolic Compounds from the Lichen Lobaria orientalis.

Identifiers

InChI

InChI=1S/C20H16O9/c1-7-5-10(25-3)9(6-21)16-11(7)18(23)28-15-8(2)14(22)12-13(17(15)27-16)20(26-4)29-19(12)24/h5-6,20,22H,1-4H3/t20-/m0/s1

0 references

InChIKey

HQNHVWVEYNXZBJ-FQEVSTJZSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HQNHVWVEYNXZBJ-FQEVSTJZSA-N

ChEBI ID

202983

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C20H16O9/c1-7-5-10(25-3)9(6-21)16-11(7)18(23)28-15-8(2)14(22)12-13(17(15)27-16)20(26-4)29-19(12)24/h5-6,20,22H,1-4H3/t20-/m0/s1

1 reference

(Q105032327)

(17S)-13-hydroxy-5,17-dimethoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

Statements

Identifiers

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