(Q110193824)

English

(2S,3R,4S,5S,6R)-2-[2,4-Dihydroxy-6-[2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

406.126382284 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S,3R,4S,5S,6R)-2-[2,4-dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S,3R,4S,5R,6R)-2-[2,4-dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₂O₉

0 references

canonical SMILES

OC1=CC=C(C=C1)C=CC=2C=C(O)C=C(O)C2OC3OC(CO)C(O)C(O)C3O

0 references

isomeric SMILES

OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2C=Cc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O

0 references

found in taxon

sisal

1 reference

stated in

Two New Steroidal Saponins from the Fresh Leaves of Agave sisalana

Identifiers

InChI

InChI=1S/C20H22O9/c21-9-15-16(25)17(26)18(27)20(28-15)29-19-11(7-13(23)8-14(19)24)4-1-10-2-5-12(22)6-3-10/h1-8,15-18,20-27H,9H2/t15-,16-,17+,18-,20+/m1/s1

0 references

InChIKey

JAYVHSBYKLLDJC-NUABRCLCSA-N

0 references

CAS Registry Number

55327-45-2

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JAYVHSBYKLLDJC-NUABRCLCSA-N

1 reference

1 reference

matched by identifier from

InChIKey

JAYVHSBYKLLDJC-NUABRCLCSA-N

(Q110193824)

(2S,3R,4S,5S,6R)-2-[2,4-Dihydroxy-6-[2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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