(Q110190545)

English

[1-hydroxy-9,9,14,18-tetramethyl-19-(4-methyl-5-oxo-2H-furan-2-yl)-5-oxo-4,8,20-trioxahexacyclo[11.10.0.03,7.03,10.014,21.017,21]tricosan-15-yl] acetate

group of stereoisomers with the chemical formula C₃₁H₄₂O₉

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

558.282882924 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₄₂O₉

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canonical SMILES

O=C1OC(C=C1C)C2OC34CCC5(O)CC67OC(=O)CC7OC(C)(C)C6CCC5C4(C)C(OC(=O)C)CC3C2C

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found in taxon

Schisandra chinensis

2 references

stated in

Isolation and characterization of miscellaneous terpenoids of Schisandra chinensis

stated in

Wuweizidilactones A-F: novel highly oxygenated nortriterpenoids with unusual skeletons isolated from Schisandra chinensis

Identifiers

InChI

InChI=1S/C31H42O9/c1-15-11-19(37-26(15)34)25-16(2)18-12-22(36-17(3)32)28(6)21-8-7-20-27(4,5)38-23-13-24(33)39-30(20,23)14-29(21,35)9-10-31(18,28)40-25/h11,16,18-23,25,35H,7-10,12-14H2,1-6H3

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InChIKey

NIEWGKGQPUZIJM-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q110190545)

[1-hydroxy-9,9,14,18-tetramethyl-19-(4-methyl-5-oxo-2H-furan-2-yl)-5-oxo-4,8,20-trioxahexacyclo[11.10.0.03,7.03,10.014,21.017,21]tricosan-15-yl] acetate

Statements

Identifiers

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