(Q105302582)

English

(2E,5R)-5-methyl-2-(1-{[(3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-ylidene)cyclohexan-1-one

group of stereoisomers with the chemical formula C₁₆H₂₆O₇

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Statements

group of stereoisomers

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menthane monoterpenoids

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menthane monoterpenoids

330.167853172 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₆H₂₆O₇

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canonical SMILES

O=C1C(=C(C)COC2OC(CO)C(O)C(O)C2O)CCC(C)C1

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isomeric SMILES

C/C(COC1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)=C1/CC[C@@H](C)CC1=O

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Identifiers

InChI=1S/C16H26O7/c1-8-3-4-10(11(18)5-8)9(2)7-22-16-15(21)14(20)13(19)12(6-17)23-16/h8,12-17,19-21H,3-7H2,1-2H3/b10-9+/t8-,12+,13+,14-,15+,16?/m1/s1

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WDPNMVOXTFKLMJ-MJSJXLAISA-N

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based on heuristic

inferred from InChIKey

matched by identifier from

WDPNMVOXTFKLMJ-MJSJXLAISA-N

UniChem compound ID

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