(Q105220943)

English

(2S,9R,13S,15S,17S)-16-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-11-[(2S,4S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-3-one

group of stereoisomers with the chemical formula C₂₈H₄₄O₁₁

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Statements

instance of

group of stereoisomers

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1 reference

556.2883622279999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₈H₄₄O₁₁

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canonical SMILES

O=C1C(OC)=CC(C)C2CC3OC(OC4OC(CO)C(O)C(O)C4O)CC5C(C)C(OC)C(O)C(C12C)C35C

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isomeric SMILES

COC1=CC(C)C2C[C@H]3OC(O[C@@H]4O[C@H](CO)C(O)[C@H](O)C4O)C[C@H]4C(C)[C@H](OC)C(O)C([C@@]2(C)C1=O)[C@]43C

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found in taxon

Picrasma quassioides

1 reference

stated in

Picrasinoside H, a new quassinoid glucoside, and related compounds from the stem wood of Picrasma ailanthoides

Identifiers

InChI

InChI=1S/C28H44O11/c1-11-7-15(35-5)25(34)28(4)13(11)8-17-27(3)14(12(2)23(36-6)22(33)24(27)28)9-18(38-17)39-26-21(32)20(31)19(30)16(10-29)37-26/h7,11-14,16-24,26,29-33H,8-10H2,1-6H3/t11?,12?,13?,14-,16+,17+,18?,19?,20-,21?,22?,23-,24?,26-,27+,28-/m0/s1

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InChIKey

QHIOXCRKDHYVLE-FPKCDKLGSA-N

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2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

QHIOXCRKDHYVLE-FPKCDKLGSA-N

1 reference

(Q105220943)

(2S,9R,13S,15S,17S)-16-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-11-[(2S,4S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-3-one

Statements

Identifiers

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