(Q105345871)

English

[(12R,13S,14R,16S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-5,11,17-trioxo-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosan-12-yl] acetate

group of stereoisomers with the chemical formula C₂₈H₃₂O₁₀

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Statements

instance of

group of stereoisomers

0 references

1 reference

528.199547224 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₂O₁₀

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canonical SMILES

O=C(OC1C(=O)C2C(OC3CC(=O)OCC32C4CCC5(C)C(OC(=O)C6OC65C14C)C7=COC=C7)(C)C)C

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isomeric SMILES

CC(=O)O[C@H]1C(=O)C2C(C)(C)OC3CC(=O)OCC32C2CCC3(C)C(c4ccoc4)OC(=O)[C@H]4O[C@]43[C@@]21C

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found in taxon

Euodia rutaecarpa

1 reference

stated in

Limonoids and quinolone alkaloids from Evodia rutaecarpa Bentham.

Identifiers

InChI

InChI=1S/C28H32O10/c1-13(29)35-21-18(31)19-24(2,3)37-16-10-17(30)34-12-27(16,19)15-6-8-25(4)20(14-7-9-33-11-14)36-23(32)22-28(25,38-22)26(15,21)5/h7,9,11,15-16,19-22H,6,8,10,12H2,1-5H3/t15?,16?,19?,20?,21-,22+,25?,26-,27?,28+/m0/s1

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InChIKey

YBJGIQUVRQCMSY-HOVZVZJHSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YBJGIQUVRQCMSY-HOVZVZJHSA-N

1 reference

(Q105345871)

[(12R,13S,14R,16S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-5,11,17-trioxo-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosan-12-yl] acetate

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Identifiers

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