(Q105028952)

English

(17S)-13,17-dihydroxy-5-methoxy-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-carboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

depsidone

0 references

mass

402.058696648 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₁₄O₁₀

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canonical SMILES

O=C(O)C1=C(OC)C=C(C=2C(=O)OC3=C(OC12)C4=C(C(=O)OC4O)C(O)=C3C)C

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isomeric SMILES

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

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found in taxon

Relicina sydneyensis

1 reference

stated in

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

Identifiers

InChI

InChI=1S/C19H14O10/c1-5-4-7(26-3)9(16(21)22)14-8(5)17(23)28-13-6(2)12(20)10-11(15(13)27-14)19(25)29-18(10)24/h4,19-20,25H,1-3H3,(H,21,22)/t19-/m0/s1

0 references

InChIKey

HIPOOOQGJTVSMG-IBGZPJMESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HIPOOOQGJTVSMG-IBGZPJMESA-N

ChEBI ID

207284

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C19H14O10/c1-5-4-7(26-3)9(16(21)22)14-8(5)17(23)28-13-6(2)12(20)10-11(15(13)27-14)19(25)29-18(10)24/h4,19-20,25H,1-3H3,(H,21,22)/t19-/m0/s1

(Q105028952)

(17S)-13,17-dihydroxy-5-methoxy-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-carboxylic acid

Statements

Identifiers

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