(Q105261634)

English

(2S,4R,7E,10S,11R)-4,8-dimethyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-7-en-10-yl (2E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate

group of stereoisomers with the chemical formula C₂₀H₂₆O₇

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Statements

group of stereoisomers

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germacrane sesquiterpenoid

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germacrane sesquiterpenoid

378.1678531719999 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₀H₂₆O₇

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canonical SMILES

O=C(OC1CC(=CCCC2(OC2C3OC(=O)C(=C)C13)C)C)C(=CCO)CO

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isomeric SMILES

C=C1C(=O)OC2[C@@H]3O[C@]3(C)CC/C=C(\C)C[C@H](OC(=O)/C(=C/CO)CO)[C@@H]12

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Identifiers

InChI=1S/C20H26O7/c1-11-5-4-7-20(3)17(27-20)16-15(12(2)18(23)26-16)14(9-11)25-19(24)13(10-22)6-8-21/h5-6,14-17,21-22H,2,4,7-10H2,1,3H3/b11-5+,13-6+/t14-,15+,16?,17-,20+/m0/s1

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SUXRDYUTTDFKDJ-NAPXJFMXSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

SUXRDYUTTDFKDJ-NAPXJFMXSA-N

UniChem compound ID

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