(Q105290253)

English

7-[6-O-(3,4-Dihydroxycinnamoyl)-beta-D-glucopyranosyloxy]-3,3',5,6-tetrahydroxy-4'-methoxyflavone

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[3,4,5-Trihydroxy-6-[3,5,6-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

656.137734816 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₂₈O₁₆

0 references

canonical SMILES

O=C(OCC1OC(OC=2C=C3OC(=C(O)C(=O)C3=C(O)C2O)C=4C=CC(OC)=C(O)C4)C(O)C(O)C1O)C=CC5=CC=C(O)C(O)=C5

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isomeric SMILES

COc1ccc(-c2oc3cc(O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O)c(O)c(O)c3c(=O)c2O)cc1O

0 references

found in taxon

Eupatorium album var. album

2 references

stated in

Flavonol glycosides from leaves of Eupatorium glandulosum

stated in

Flavonol glycosides from leaves of Eupatorium glandulosum

Identifiers

InChI

InChI=1S/C31H28O16/c1-43-17-6-4-13(9-16(17)34)30-28(41)26(39)22-18(45-30)10-19(23(36)25(22)38)46-31-29(42)27(40)24(37)20(47-31)11-44-21(35)7-3-12-2-5-14(32)15(33)8-12/h2-10,20,24,27,29,31-34,36-38,40-42H,11H2,1H3/b7-3+/t20-,24-,27+,29-,31-/m1/s1

0 references

InChIKey

VOLQPULSOMKKEF-JHCQQDQRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VOLQPULSOMKKEF-JHCQQDQRSA-N

1 reference

1 reference

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

retrieved

15 January 2022

InChIKey

VOLQPULSOMKKEF-JHCQQDQRSA-N

(Q105290253)

7-[6-O-(3,4-Dihydroxycinnamoyl)-beta-D-glucopyranosyloxy]-3,3',5,6-tetrahydroxy-4'-methoxyflavone

Statements

Identifiers

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