(Q104400558)

English

[3,4,5-Trihydroxy-6-[(4-hydroxy-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl)oxy]oxan-2-yl]methyl 2-(4-hydroxyphenyl)acetate

group of stereoisomers with the chemical formula C₂₉H₃₄O₁₁

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Statements

instance of

group of stereoisomers

0 references

subclass of

guaiane sesquiterpenoid

1 reference

inferred from

guaiane sesquiterpenoid

mass

558.210111908 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₄O₁₁

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canonical SMILES

O=C1OC2C(C1=C)C(O)CC(=C)C3CC(OC4OC(COC(=O)CC5=CC=C(O)C=C5)C(O)C(O)C4O)C(=C)C23

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found in taxon

Youngia japonica

1 reference

stated in

Studies on the constituents of whole plants of Youngia japonica.

Identifiers

InChI

InChI=1S/C29H34O11/c1-12-8-18(31)23-14(3)28(36)40-27(23)22-13(2)19(10-17(12)22)38-29-26(35)25(34)24(33)20(39-29)11-37-21(32)9-15-4-6-16(30)7-5-15/h4-7,17-20,22-27,29-31,33-35H,1-3,8-11H2

0 references

InChIKey

HBASBIUAPMYXFM-UHFFFAOYSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104400558)

[3,4,5-Trihydroxy-6-[(4-hydroxy-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl)oxy]oxan-2-yl]methyl 2-(4-hydroxyphenyl)acetate

Statements

Identifiers

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