U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C19H18O8
Molecular Weight 374.3414
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CASTICIN

SMILES

COC1=CC=C(C=C1O)C2=C(OC)C(=O)C3=C(O)C(OC)=C(OC)C=C3O2

InChI

InChIKey=PJQLSMYMOKWUJG-UHFFFAOYSA-N
InChI=1S/C19H18O8/c1-23-11-6-5-9(7-10(11)20)17-19(26-4)16(22)14-12(27-17)8-13(24-2)18(25-3)15(14)21/h5-8,20-21H,1-4H3

HIDE SMILES / InChI

Molecular Formula C19H18O8
Molecular Weight 374.3414
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Tracheospasmolytic activity of viteosin-A and vitexicarpin isolated from vitex trifolia.
2002 Nov
Cytotoxic flavone analogues of vitexicarpin, a constituent of the leaves of Vitex negundo.
2003 Jun
Characteristics, clinical effect profile and tolerability of a nasal spray preparation of Artemisia abrotanum L. for allergic rhinitis.
2004 Jan
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:50:33 GMT 2023
Edited
by admin
on Fri Dec 15 18:50:33 GMT 2023
Record UNII
753GT729OU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CASTICIN
USP-RS  
Common Name English
4H-1-BENZOPYRAN-4-ONE, 5-HYDROXY-2-(3-HYDROXY-4-METHOXYPHENYL)-3,6,7-TRIMETHOXY-
Systematic Name English
CASTICIN [USP-RS]
Common Name English
5-HYDROXY-2-(3-HYDROXY-4-METHOXY-PHENYL)-3,6,7-TRIMETHOXY-CHROMEN-4-ONE
Systematic Name English
Code System Code Type Description
CAS
479-91-4
Created by admin on Fri Dec 15 18:50:33 GMT 2023 , Edited by admin on Fri Dec 15 18:50:33 GMT 2023
PRIMARY
WIKIPEDIA
Casticin
Created by admin on Fri Dec 15 18:50:33 GMT 2023 , Edited by admin on Fri Dec 15 18:50:33 GMT 2023
PRIMARY
RS_ITEM_NUM
1096779
Created by admin on Fri Dec 15 18:50:33 GMT 2023 , Edited by admin on Fri Dec 15 18:50:33 GMT 2023
PRIMARY
FDA UNII
753GT729OU
Created by admin on Fri Dec 15 18:50:33 GMT 2023 , Edited by admin on Fri Dec 15 18:50:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID80197326
Created by admin on Fri Dec 15 18:50:33 GMT 2023 , Edited by admin on Fri Dec 15 18:50:33 GMT 2023
PRIMARY
PUBCHEM
5315263
Created by admin on Fri Dec 15 18:50:33 GMT 2023 , Edited by admin on Fri Dec 15 18:50:33 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
ASSAY (HPLC)