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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H22O9
Molecular Weight 418.394
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NATSUDAIDAIN

SMILES

COC1=C(OC)C=C(C=C1)C2=C(O)C(=O)C3=C(O2)C(OC)=C(OC)C(OC)=C3OC

InChI

InChIKey=CCJBNIRSVUKABH-UHFFFAOYSA-N
InChI=1S/C21H22O9/c1-24-11-8-7-10(9-12(11)25-2)16-15(23)14(22)13-17(26-3)19(27-4)21(29-6)20(28-5)18(13)30-16/h7-9,23H,1-6H3

HIDE SMILES / InChI

Molecular Formula C21H22O9
Molecular Weight 418.394
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Quantitative study of fruit flavonoids in citrus hybrids of King (C. nobilis) and Mukaku Kishu (C. kinokuni).
2001 Aug
A citrus polymethoxyflavonoid, nobiletin, is a novel MEK inhibitor that exhibits antitumor metastasis in human fibrosarcoma HT-1080 cells.
2008 Feb 1
Effect of natsudaidain isolated from Citrus plants on TNF-alpha and cyclooxygenase-2 expression in RBL-2H3 cells.
2009 Jan
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:00:28 GMT 2023
Edited
by admin
on Sat Dec 16 11:00:28 GMT 2023
Record UNII
28441ILD21
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NATSUDAIDAIN
Common Name English
4H-1-BENZOPYRAN-4-ONE, 2-(3,4-DIMETHOXYPHENYL)-3-HYDROXY-5,6,7,8-TETRAMETHOXY-
Systematic Name English
Code System Code Type Description
FDA UNII
28441ILD21
Created by admin on Sat Dec 16 11:00:28 GMT 2023 , Edited by admin on Sat Dec 16 11:00:28 GMT 2023
PRIMARY
CAS
35154-55-3
Created by admin on Sat Dec 16 11:00:28 GMT 2023 , Edited by admin on Sat Dec 16 11:00:28 GMT 2023
PRIMARY
PUBCHEM
3084605
Created by admin on Sat Dec 16 11:00:28 GMT 2023 , Edited by admin on Sat Dec 16 11:00:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID00188655
Created by admin on Sat Dec 16 11:00:28 GMT 2023 , Edited by admin on Sat Dec 16 11:00:28 GMT 2023
PRIMARY
WIKIPEDIA
Natsudaidain
Created by admin on Sat Dec 16 11:00:28 GMT 2023 , Edited by admin on Sat Dec 16 11:00:28 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
18% Cell growth rate of mouse myeloid leukemia M1 cells at 50 uM of compound vs control
PARENT -> CONSTITUENT ALWAYS PRESENT
42% Cell growth rate of human acute promyelocytic leukemia HL-60 cells at 50 uM of compound vs control