(Q104167259)

English

[3-(4-Hydroxy-2-methyl-6-oxocyclohexen-1-yl)-7-methyl-6,8-dioxoisochromen-7-yl] 2-methyloct-2-enoate

group of stereoisomers with the chemical formula C₂₆H₃₀O₇

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

454.1991533 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₀O₇

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canonical SMILES

O=C(OC1(C(=O)C=C2C=C(OC=C2C1=O)C=3C(=O)CC(O)CC3C)C)C(=CCCCCC)C

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found in taxon

Annulohypoxylon cohaerens

1 reference

stated in

Cohaerins A and B, azaphilones from the fungus Hypoxylon cohaerens, and comparison of HPLC-based metabolite profiles in Hypoxylon sect. Annulata

Identifiers

InChI

InChI=1S/C26H30O7/c1-5-6-7-8-9-15(2)25(31)33-26(4)22(29)12-17-11-21(32-14-19(17)24(26)30)23-16(3)10-18(27)13-20(23)28/h9,11-12,14,18,27H,5-8,10,13H2,1-4H3

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InChIKey

GKVWLPVTYNGYQO-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GKVWLPVTYNGYQO-UHFFFAOYSA-N

(Q104167259)

[3-(4-Hydroxy-2-methyl-6-oxocyclohexen-1-yl)-7-methyl-6,8-dioxoisochromen-7-yl] 2-methyloct-2-enoate

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Identifiers

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