(Q105124263)

English

(1R,2R,3R,6R,15R,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione

group of stereoisomers with the chemical formula C₂₀H₂₆O₉

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Statements

instance of

group of stereoisomers

0 references

1 reference

410.157682412 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₉

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canonical SMILES

O=C1OC2CC3C(=CC(=O)C(O)C3(C)C4C(O)C(O)C5(OCC24C5(O)C1O)C)C

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isomeric SMILES

CC1=CC(=O)C(O)C2(C)C1C[C@H]1OC(=O)[C@H](O)[C@@]3(O)[C@]4(C)OC[C@]13C2[C@@H](O)C4O

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found in taxon

Samadera indica

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stated in

Indonesian medicinal plants. XVII. Characterization of quassinoids from the stems of Quassia indica.

Homalolepis cedron

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stated in

Cytotoxic quassinoids from Simaba cedron

Identifiers

InChI

InChI=1S/C20H26O9/c1-7-4-9(21)13(23)17(2)8(7)5-10-19-6-28-18(3,14(24)11(22)12(17)19)20(19,27)15(25)16(26)29-10/h4,8,10-15,22-25,27H,5-6H2,1-3H3/t8?,10-,11-,12?,13?,14?,15+,17?,18-,19-,20-/m1/s1

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InChIKey

JBDMZGKDLMGOFR-RBALYHODSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JBDMZGKDLMGOFR-RBALYHODSA-N

1 reference

(Q105124263)

(1R,2R,3R,6R,15R,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione

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Identifiers

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