(Q105268477)

English

3,10-dimethyl-2-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-6-carbaldehyde

group of stereoisomers with the chemical formula C₂₁H₃₀O₉

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Statements

instance of

group of stereoisomers

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subclass of

germacrane sesquiterpenoid

1 reference

inferred from

germacrane sesquiterpenoid

mass

426.18898254 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₀O₉

0 references

canonical SMILES

O=CC1=CCC(OC2OC(CO)C(O)C(O)C2O)C(=CC3OC(=O)C(C)C3CC1)C

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found in taxon

Lactuca perennis

1 reference

stated in

Sesquiterpene lactones from Lactuca laciniata

Lactuca saligna

1 reference

stated in

Sesquiterpene lactones from Lactuca laciniata

Lactuca quercina

1 reference

stated in

Sesquiterpene lactones from Lactuca laciniata

Identifiers

InChI

InChI=1S/C21H30O9/c1-10-7-15-13(11(2)20(27)28-15)5-3-12(8-22)4-6-14(10)29-21-19(26)18(25)17(24)16(9-23)30-21/h4,7-8,11,13-19,21,23-26H,3,5-6,9H2,1-2H3

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InChIKey

TZXUUTQEICXCOH-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TZXUUTQEICXCOH-UHFFFAOYSA-N

(Q105268477)

3,10-dimethyl-2-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-6-carbaldehyde

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Identifiers

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