(Q105220870)

English

7-hydroxy-6,13-dimethoxy-14-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

chemical compound

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instance of

type of chemical entity

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subclass of

7-Hydroxy-6,13-dimethoxy-14-(3,4,5-trihydroxyoxan-2-yl)oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

1 reference

based on heuristic

inferred from SMILES

mass

462.079826016 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₁₈O₁₂

0 references

canonical SMILES

O=C1OC2=C(O)C(OC)=CC=3C(=O)OC=4C(OC5OCC(O)C(O)C5O)=C(OC)C=C1C4C23

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isomeric SMILES

COc1cc2c(=O)oc3c(O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)c(OC)cc4c(=O)oc(c1O)c2c34

0 references

found in taxon

Miconia myriantha

1 reference

stated in

Phenolic compounds from Miconia myriantha inhibiting Candida aspartic proteases

Identifiers

InChI

InChI=1S/C21H18O12/c1-28-9-3-6-11-12-7(19(26)31-17(11)14(9)24)4-10(29-2)16(18(12)32-20(6)27)33-21-15(25)13(23)8(22)5-30-21/h3-4,8,13,15,21-25H,5H2,1-2H3/t8-,13+,15-,21+/m1/s1

0 references

InChIKey

QHDQQESTGYADJU-YCFLMIGYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QHDQQESTGYADJU-YCFLMIGYSA-N

(Q105220870)

7-hydroxy-6,13-dimethoxy-14-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

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