(Q105161793)

English

12-[(R)-[(2S)-3,3-dimethyloxiran-2-yl]-hydroxymethyl]-5,8-dihydroxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2,2-Dimethyl-5,8-dihydroxy-12-[hydroxy(3,3-dimethyloxiranyl)methyl]-2H,6H-pyrano[3,2-b]xanthene-6-one

1 reference

based on heuristic

inferred from SMILES

mass

410.136553044 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

12-[(S)-[(2S)-3,3-dimethyloxiran-2-yl]-hydroxymethyl]-5,8-dihydroxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₂O₇

0 references

canonical SMILES

O=C1C2=CC(O)=CC=C2OC=3C1=C(O)C=4C=CC(OC4C3C(O)C5OC5(C)C)(C)C

0 references

isomeric SMILES

CC1(C)C=Cc2c(c([C@@H](O)[C@@H]3OC3(C)C)c3oc4ccc(O)cc4c(=O)c3c2O)O1

0 references

found in taxon

Calophyllum brasiliense

2 references

stated in

Chemical constituents of Calophyllum brasiliense. 2. Structure of three new coumarins and cancer chemopreventive activity of 4-substituted coumarins

stated in

Chemical constituents of Calophyllum brasiliensis: structure elucidation of seven new xanthones and their cancer chemopreventive activity

Identifiers

InChI

InChI=1S/C23H22O7/c1-22(2)8-7-11-16(25)14-17(26)12-9-10(24)5-6-13(12)28-20(14)15(19(11)29-22)18(27)21-23(3,4)30-21/h5-9,18,21,24-25,27H,1-4H3/t18-,21+/m1/s1

0 references

InChIKey

MDJODYOPXIPBEH-NQIIRXRSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MDJODYOPXIPBEH-NQIIRXRSSA-N

(Q105161793)

12-[(R)-[(2S)-3,3-dimethyloxiran-2-yl]-hydroxymethyl]-5,8-dihydroxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one

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Identifiers

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