(Q105150573)

English

(E)-1-[2-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

1-[2-[3,4-Dihydroxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one

1 reference

based on heuristic

inferred from SMILES

mass

550.16864102 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₀O₁₃

0 references

canonical SMILES

O=C(C=CC1=CC=C(O)C=C1)C=2C(O)=CC(O)=CC2OC3OCC(OC4OC(C)C(O)C(O)C4O)C(O)C3O

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isomeric SMILES

C[C@@H]1O[C@@H](O[C@@H]2CO[C@@H](Oc3cc(O)cc(O)c3C(=O)/C=C/c3ccc(O)cc3)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

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found in taxon

Acacia dealbata

1 reference

stated in

A chalcone glycoside from Acacia dealbata

Identifiers

InChI

InChI=1S/C26H30O13/c1-11-20(31)22(33)24(35)26(37-11)39-18-10-36-25(23(34)21(18)32)38-17-9-14(28)8-16(30)19(17)15(29)7-4-12-2-5-13(27)6-3-12/h2-9,11,18,20-28,30-35H,10H2,1H3/b7-4+/t11-,18+,20-,21-,22+,23+,24+,25-,26-/m0/s1

0 references

InChIKey

LEHJVTGYXXQXJI-QQYUGMHASA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

retrieved

15 January 2022

InChIKey

LEHJVTGYXXQXJI-QQYUGMHASA-N

(Q105150573)

(E)-1-[2-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one

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