(Q105268751)

English

6-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyloxan-2-yl]-5,7-dihydroxy-2-[4-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6C-substituted flavone

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mass

592.179205704 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₂O₁₄

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canonical SMILES

O=C1C=C(OC2=CC(O)=C(C(O)=C12)C3OC(C)C(O)C(O)C3)C=4C=CC(OC)=C(OC5OC(CO)C(O)C(O)C5O)C4

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isomeric SMILES

COc1ccc(-c2cc(=O)c3c(O)c([C@@H]4C[C@H](O)[C@H](O)[C@H](C)O4)c(O)cc3o2)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Senna occidentalis

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stated in

C-Glycosidic flavonoids from Cassia occidentalis

Senna sophera

1 reference

stated in

Studies on the Constituents of Purgative Crude Drugs. Part XXIX. Studies on the Constituents of the Leaves of Cassia torosa CAV. III. The Structures of Two New Flavone Glycosides.

Identifiers

InChI

InChI=1S/C28H32O14/c1-10-23(33)14(32)8-18(39-10)21-13(31)7-19-22(25(21)35)12(30)6-16(40-19)11-3-4-15(38-2)17(5-11)41-28-27(37)26(36)24(34)20(9-29)42-28/h3-7,10,14,18,20,23-24,26-29,31-37H,8-9H2,1-2H3/t10-,14-,18-,20+,23+,24+,26-,27+,28+/m0/s1

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InChIKey

UAGXUOZTLLGXAK-NQAHUUGOSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

UAGXUOZTLLGXAK-NQAHUUGOSA-N

1 reference

(Q105268751)

6-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyloxan-2-yl]-5,7-dihydroxy-2-[4-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one

Statements

Identifiers

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