(Q104909236)

English

6-[(2S,3R,4S,5R,6R)-3-[(2S,3S,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one

chemical compound

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instance of

type of chemical entity

0 references

1 reference

578.16355564 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₀O₁₄

0 references

canonical SMILES

O=C1C=C(OC=2C=C(OC)C(=C(O)C12)C3OC(CO)C(O)C(O)C3OC4OCC(O)(CO)C4O)C=5C=CC(O)=CC5

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isomeric SMILES

COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1OC[C@](O)(CO)[C@@H]1O

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found in taxon

Abrus precatorius

1 reference

stated in

Saponins and C-Glycosyl Flavones from the Seeds of Abrus precatorius.

Identifiers

InChI

InChI=1S/C27H30O14/c1-37-15-7-16-18(13(31)6-14(39-16)11-2-4-12(30)5-3-11)21(33)19(15)23-24(22(34)20(32)17(8-28)40-23)41-26-25(35)27(36,9-29)10-38-26/h2-7,17,20,22-26,28-30,32-36H,8-10H2,1H3/t17-,20+,22+,23+,24-,25-,26+,27-/m1/s1

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InChIKey

ACQJLHGCCNJDOD-XDGYSQEVSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ACQJLHGCCNJDOD-XDGYSQEVSA-N

(Q104909236)

6-[(2S,3R,4S,5R,6R)-3-[(2S,3S,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one

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