(Q104402152)

English

(2S,3S,4R,5R,6S)-2-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₂₅H₃₄O₈

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instance of

group of stereoisomers

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462.2253680479999 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₅H₃₄O₈

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canonical SMILES

OC1=CC=C(C=C1)CCCCC(OC2OC(CO)C(O)C(O)C2O)CCC3=CC=C(O)C=C3

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isomeric SMILES

OC[C@@H]1O[C@H](OC(CCCCc2ccc(O)cc2)CCc2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O

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Identifiers

InChI

InChI=1S/C25H34O8/c26-15-21-22(29)23(30)24(31)25(33-21)32-20(14-9-17-7-12-19(28)13-8-17)4-2-1-3-16-5-10-18(27)11-6-16/h5-8,10-13,20-31H,1-4,9,14-15H2/t20?,21-,22-,23+,24-,25-/m0/s1

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InChIKey

MAUAGULXOHJIER-MVMXRKHSSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

MAUAGULXOHJIER-MVMXRKHSSA-N

1 reference

(Q104402152)

(2S,3S,4R,5R,6S)-2-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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