(Q105178300)

English

(3S,4R,5R,6S)-2-[(3R,6E)-8-hydroxy-3,7-dimethylocta-1,6-dien-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₁₆H₂₈O₇

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Statements

instance of

group of stereoisomers

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subclass of

2,6-dimethyloctane monoterpenoid

1 reference

inferred from

2,6-dimethyloctane monoterpenoid

mass

332.183503236 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₆H₂₈O₇

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canonical SMILES

OCC(=CCCC(OC1OC(CO)C(O)C(O)C1O)(C=C)C)C

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isomeric SMILES

C=C[C@@](C)(CC/C=C(\C)CO)OC1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O

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found in taxon

Caroxylon tetrandrum

1 reference

stated in

Phytochemical Constituents from Salsola tetrandra

Identifiers

InChI

InChI=1S/C16H28O7/c1-4-16(3,7-5-6-10(2)8-17)23-15-14(21)13(20)12(19)11(9-18)22-15/h4,6,11-15,17-21H,1,5,7-9H2,2-3H3/b10-6+/t11-,12-,13+,14-,15?,16-/m0/s1

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InChIKey

NEZCMGYOACDFPH-WOXHDHDISA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NEZCMGYOACDFPH-WOXHDHDISA-N

(Q105178300)

(3S,4R,5R,6S)-2-[(3R,6E)-8-hydroxy-3,7-dimethylocta-1,6-dien-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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