(Q72443736)

English

Arillatose B

chemical compound

6'-O-Feruloylsucrose

In more languages

Statements

type of chemical entity

0 references

alkyl caffeate ester

1 reference

based on heuristic

inferred from SMILES

518.1635556399998 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

coumaroyl(3-OMe)(-6)Glc(a1-2b)L-Fruf

1 reference

based on heuristic

inferred from InChI

[(2R,3S,4S,5R,6R)-6-{[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from InChI

[(2R,3S,4S,5R,6R)-6-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₀O₁₄

0 references

canonical SMILES

COc1cc(C=CC(=O)OCC2OC(OC3(CO)OC(CO)C(O)C3O)C(O)C(O)C2O)ccc1O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COc1cc(/C=C/C(=O)OC[C@H]2O[C@H](OC3(CO)OC(CO)C(O)C3O)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C22H30O14/c1-32-12-6-10(2-4-11(12)25)3-5-15(26)33-8-14-16(27)18(29)19(30)21(34-14)36-22(9-24)20(31)17(28)13(7-23)35-22/h2-6,13-14,16-21,23-25,27-31H,7-9H2,1H3/b5-3+/t13?,14-,16-,17?,18+,19-,20?,21-,22?/m1/s1

0 references

XMBZZLUIFFOAHR-WVUOLQOHSA-N

1 reference

based on heuristic

inferred from InChI

CAS Registry Number

0 references

1 reference

matched by identifier from

XMBZZLUIFFOAHR-WVUOLQOHSA-N

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