(Q104967644)

English

(1R,2S,4R,6R,7S,10S,11R)-17-hydroxy-6-(2-hydroxy-5-oxo-2H-furan-4-yl)-7,11,15,15-tetramethyl-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadeca-12,16-diene-14,18-dione

group of stereoisomers with the chemical formula C₂₅H₂₈O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

440.183503236 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₈O₇

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canonical SMILES

O=C1OC(O)C=C1C2CC3OC34C5C(=O)C(O)=C6C(C=CC(=O)C6(C)C)(C)C5CCC24C

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isomeric SMILES

CC1(C)C(=O)C=C[C@@]2(C)C1=C(O)C(=O)[C@@H]1[C@@H]2CC[C@@]2(C)[C@H](C3=CC(O)OC3=O)C[C@H]3O[C@@]312

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found in taxon

Toona ciliata

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stated in

Limonoids from Toona ciliata and speculations on their chemosystematic and ecological significance

Identifiers

InChI

InChI=1S/C25H28O7/c1-22(2)14(26)6-7-23(3)12-5-8-24(4)13(11-9-16(27)31-21(11)30)10-15-25(24,32-15)17(12)18(28)19(29)20(22)23/h6-7,9,12-13,15-17,27,29H,5,8,10H2,1-4H3/t12-,13-,15+,16?,17-,23+,24-,25-/m0/s1

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InChIKey

CPMCNKDHOFJOKA-LOOICGLASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CPMCNKDHOFJOKA-LOOICGLASA-N

(Q104967644)

(1R,2S,4R,6R,7S,10S,11R)-17-hydroxy-6-(2-hydroxy-5-oxo-2H-furan-4-yl)-7,11,15,15-tetramethyl-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadeca-12,16-diene-14,18-dione

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Identifiers

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