(Q115971582)

English

[(1R,4S,5R,6S,7R,8R,11R,13S,17S,18S,19R)-8-acetyloxy-4,7,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-5-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

494.17881178 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R)-1,3abeta,11beta-Trihydroxy-2alpha,4beta-diacetoxy-3alpha,8,11abeta-trimethyl-1beta,11cbeta-(epoxymethano)-1,2,3,3a,4,5,6abeta,7aalpha,10,11,11a,11balpha,11c-tridecahydro-6-oxa-7H-benzo[de]anthracene-5,10-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₃₀O₁₁

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canonical SMILES

O=C(OC1C(=O)OC2CC3C(=CC(=O)C(O)C3(C)C4C5(O)OCC24C1(O)C(C)C5OC(=O)C)C)C

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isomeric SMILES

CC(=O)O[C@@H]1[C@H](C)[C@]2(O)[C@@H](OC(C)=O)C(=O)O[C@@H]3C[C@H]4C(C)=CC(=O)[C@@H](O)[C@]4(C)[C@H]4[C@]1(O)OC[C@]432

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found in taxon

Eurycoma longifolia

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stated in

Quassinoids from Eurycoma longifolia

stated in

Quassinoids from Eurycoma longifolia

Identifiers

InChI

InChI=1S/C24H30O11/c1-9-6-14(27)16(28)21(5)13(9)7-15-22-8-32-24(31,20(21)22)17(33-11(3)25)10(2)23(22,30)18(19(29)35-15)34-12(4)26/h6,10,13,15-18,20,28,30-31H,7-8H2,1-5H3/t10-,13-,15+,16+,17+,18-,20+,21+,22+,23-,24+/m0/s1

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InChIKey

UJKLOPRFQLDSMC-HAISWCHUSA-N

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1 reference

3 January 2023

inferred from InChIKey

1 reference

(Q115971582)

[(1R,4S,5R,6S,7R,8R,11R,13S,17S,18S,19R)-8-acetyloxy-4,7,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-5-yl] acetate

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Identifiers

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