(Q105236895)

English

Isousone

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4,12-diacetyl-7-ethoxy-3,11,13-trihydroxy-2,10-dimethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),3,9,11-tetraen-5-one

1 reference

based on heuristic

inferred from SMILES

mass

390.131467664 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂O₈

0 references

canonical SMILES

O=C(C=1C(O)=C(C=2OC3(OCC)CC(=O)C(C(=O)C)=C(O)C3(C2C1O)C)C)C

0 references

isomeric SMILES

CCO[C@@]12CC(=O)C(C(C)=O)=C(O)[C@]1(C)c1c(O)c(C(C)=O)c(O)c(C)c1O2

0 references

found in taxon

Dolichousnea longissima

1 reference

stated in

Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima.

Identifiers

InChI

InChI=1S/C20H22O8/c1-6-27-20-7-11(23)12(9(3)21)18(26)19(20,5)14-16(25)13(10(4)22)15(24)8(2)17(14)28-20/h24-26H,6-7H2,1-5H3/t19-,20+/m0/s1

0 references

InChIKey

RIIQHPRJWQNETO-VQTJNVASSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

RIIQHPRJWQNETO-VQTJNVASSA-N

ChEBI ID

227689

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C20H22O8/c1-6-27-20-7-11(23)12(9(3)21)18(26)19(20,5)14-16(25)13(10(4)22)15(24)8(2)17(14)28-20/h24-26H,6-7H2,1-5H3/t19-,20+/m0/s1

1 reference

Natural Product Atlas ID

NPA021941

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

RIIQHPRJWQNETO-VQTJNVASSA-N

(Q105236895)

Isousone

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Identifiers

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