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Details

Stereochemistry UNKNOWN
Molecular Formula C21H22O6
Molecular Weight 370.3958
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of XANTHOANGELOL E

SMILES

COC1=CC=C(C(=O)\C=C\C2=CC=C(O)C=C2)C(O)=C1CC(OO)C(C)=C

InChI

InChIKey=AJERVVHSERWGFL-UXBLZVDNSA-N
InChI=1S/C21H22O6/c1-13(2)20(27-25)12-17-19(26-3)11-9-16(21(17)24)18(23)10-6-14-4-7-15(22)8-5-14/h4-11,20,22,24-25H,1,12H2,2-3H3/b10-6+

HIDE SMILES / InChI

Molecular Formula C21H22O6
Molecular Weight 370.3958
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:38:20 UTC 2023
Edited
by admin
on Sat Dec 16 15:38:20 UTC 2023
Record UNII
6TIJ704AEZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTHOANGELOL E
Common Name English
2-PROPEN-1-ONE, 1-(3-(2-HYDROPEROXY-3-METHYL-3-BUTEN-1-YL)-2-HYDROXY-4-METHOXYPHENYL)-3-(4-HYDROXYPHENYL)-, (2E)-
Systematic Name English
2',4-DIHYDROXY-4'-METHOXY-3'-(2-HYDROPEROXY-3-METHYL-3-BUTENYL)CHALCONE
Common Name English
ASHITABA-CHALCONE
Common Name English
2-PROPEN-1-ONE, 1-(3-(2-HYDROPEROXY-3-METHYL-3-BUTENYL)-2-HYDROXY-4-METHOXYPHENYL)-3-(4-HYDROXYPHENYL)-, (2E)-
Systematic Name English
2-PROPEN-1-ONE, 1-(3-(2-HYDROPEROXY-3-METHYL-3-BUTENYL)-2-HYDROXY-4-METHOXYPHENYL)-3-(4-HYDROXYPHENYL)-, (E)-
Systematic Name English
(2E)-1-(3-(2-HYDROPEROXY-3-METHYL-3-BUTEN-1-YL)-2-HYDROXY-4-METHOXYPHENYL)-3-(4-HYDROXYPHENYL)-2-PROPEN-1-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
6TIJ704AEZ
Created by admin on Sat Dec 16 15:38:21 UTC 2023 , Edited by admin on Sat Dec 16 15:38:21 UTC 2023
PRIMARY
CAS
132998-84-6
Created by admin on Sat Dec 16 15:38:21 UTC 2023 , Edited by admin on Sat Dec 16 15:38:21 UTC 2023
PRIMARY
PUBCHEM
10022050
Created by admin on Sat Dec 16 15:38:21 UTC 2023 , Edited by admin on Sat Dec 16 15:38:21 UTC 2023
PRIMARY
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TARGET -> INHIBITOR
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PARENT -> CONSTITUENT ALWAYS PRESENT
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