(Q105379639)

English

5-hydroxy-6,7-dimethoxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]chromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

flavone

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mass

622.189770388 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₄O₁₅

0 references

canonical SMILES

O=C1C=C(OC2=CC(OC)=C(OC)C(O)=C12)C=3C=CC(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)=CC3

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isomeric SMILES

COc1cc2oc(-c3ccc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3)cc(=O)c2c(O)c1OC

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found in taxon

Cirsium brevistylum

1 reference

stated in

Cirsimaritin-4′-O-rutinoside, a new flavone glycoside from Cirsium brevistylum

Identifiers

InChI

InChI=1S/C29H34O15/c1-11-20(31)23(34)25(36)28(41-11)40-10-18-21(32)24(35)26(37)29(44-18)42-13-6-4-12(5-7-13)15-8-14(30)19-16(43-15)9-17(38-2)27(39-3)22(19)33/h4-9,11,18,20-21,23-26,28-29,31-37H,10H2,1-3H3/t11-,18-,20+,21-,23+,24+,25-,26-,28-,29-/m1/s1

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InChIKey

ZMPLHPSMBHMGHQ-FKCFSZFKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZMPLHPSMBHMGHQ-FKCFSZFKSA-N

(Q105379639)

5-hydroxy-6,7-dimethoxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]chromen-4-one

Statements

Identifiers

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