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Details

Stereochemistry UNKNOWN
Molecular Formula C21H20O7
Molecular Weight 384.3793
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LICOPYRANOCOUMARIN

SMILES

COC1=C2C=C(C(=O)OC2=CC3=C1CCC(C)(CO)O3)C4=C(O)C=C(O)C=C4

InChI

InChIKey=MOBCUWLJOZHPQL-UHFFFAOYSA-N
InChI=1S/C21H20O7/c1-21(10-22)6-5-13-18(28-21)9-17-15(19(13)26-2)8-14(20(25)27-17)12-4-3-11(23)7-16(12)24/h3-4,7-9,22-24H,5-6,10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C21H20O7
Molecular Weight 384.3793
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Anti-human immunodeficiency virus phenolics from licorice.
1988 Jun
Transcriptional suppression of the HIV promoter by natural compounds.
2003 Mar
CYP3A4 inhibitors isolated from Licorice.
2005 Oct
Blockade of the dioxin pathway by herbal medicine Formula Bupleuri Minor: identification of active entities for suppression of AhR activation.
2008 May
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:22:03 UTC 2023
Edited
by admin
on Sat Dec 16 09:22:03 UTC 2023
Record UNII
4X8VZO798F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LICOPYRANOCOUMARIN
Common Name English
2H,6H-BENZO(1,2-B:5,4-B')DIPYRAN-2-ONE, 3-(2,4-DIHYDROXYPHENYL)-7,8-DIHYDRO-8-(HYDROXYMETHYL)-5-METHOXY-8-METHYL-, (+)-
Systematic Name English
Code System Code Type Description
PUBCHEM
122851
Created by admin on Sat Dec 16 09:22:03 UTC 2023 , Edited by admin on Sat Dec 16 09:22:03 UTC 2023
PRIMARY
FDA UNII
4X8VZO798F
Created by admin on Sat Dec 16 09:22:03 UTC 2023 , Edited by admin on Sat Dec 16 09:22:03 UTC 2023
PRIMARY
EPA CompTox
DTXSID20922255
Created by admin on Sat Dec 16 09:22:03 UTC 2023 , Edited by admin on Sat Dec 16 09:22:03 UTC 2023
PRIMARY
CAS
117038-80-9
Created by admin on Sat Dec 16 09:22:03 UTC 2023 , Edited by admin on Sat Dec 16 09:22:03 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Coumarin