(Q105100090)

English

(3aS,4R,7aR)-4-hydroxy-5-(5-hydroxypentan-2-yl)-6-methyl-3-methylidene-3a,4,7,7a-tetrahydro-1-benzofuran-2-one

group of stereoisomers with the chemical formula C₁₅H₂₂O₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

266.151809184 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₅H₂₂O₄

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canonical SMILES

O=C1OC2CC(=C(C(O)C2C1=C)C(C)CCCO)C

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isomeric SMILES

C=C1C(=O)O[C@@H]2CC(C)=C(C(C)CCCO)[C@H](O)[C@H]12

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Identifiers

InChI

InChI=1S/C15H22O4/c1-8(5-4-6-16)12-9(2)7-11-13(14(12)17)10(3)15(18)19-11/h8,11,13-14,16-17H,3-7H2,1-2H3/t8?,11-,13-,14+/m1/s1

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InChIKey

ASZIGQFYGXSPCO-COIIJPPFSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

ASZIGQFYGXSPCO-COIIJPPFSA-N

1 reference

(Q105100090)

(3aS,4R,7aR)-4-hydroxy-5-(5-hydroxypentan-2-yl)-6-methyl-3-methylidene-3a,4,7,7a-tetrahydro-1-benzofuran-2-one

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