(Q105218965)

English

[(2R,3S,4R,5S)-4,5-dihydroxy-2-[(3S,6E)-3,7,11-trimethyl-9-oxododeca-1,6,10-trien-3-yl]oxyoxan-3-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[4,5-Dihydroxy-2-(3,7,11-trimethyl-9-oxododeca-1,6,10-trien-3-yl)oxyoxan-3-yl] acetate

1 reference

based on heuristic

inferred from SMILES

410.230453428 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₄O₇

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canonical SMILES

O=C(OC1C(OCC(O)C1O)OC(C=C)(C)CCC=C(C)CC(=O)C=C(C)C)C

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isomeric SMILES

C=C[C@](C)(CC/C=C(\C)CC(=O)C=C(C)C)O[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1OC(C)=O

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Polyachyrus fuscus

1 reference

Highly oxygenated sesquiterpenes from Polyachyrus sphaerocephalus and further constituents from chilean mutisieae

Identifiers

InChI=1S/C22H34O7/c1-7-22(6,10-8-9-15(4)12-17(24)11-14(2)3)29-21-20(28-16(5)23)19(26)18(25)13-27-21/h7,9,11,18-21,25-26H,1,8,10,12-13H2,2-6H3/b15-9+/t18-,19+,20-,21+,22+/m0/s1

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QDTLKMXDFKLFMH-LPUQRJMRSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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