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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24O9
Molecular Weight 408.3992
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NODAKENIN

SMILES

CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]2CC3=CC4=C(OC(=O)C=C4)C=C3O2

InChI

InChIKey=HXCGUCZXPFBNRD-DNLMCPORSA-N
InChI=1S/C20H24O9/c1-20(2,29-19-18(25)17(24)16(23)13(8-21)28-19)14-6-10-5-9-3-4-15(22)27-11(9)7-12(10)26-14/h3-5,7,13-14,16-19,21,23-25H,6,8H2,1-2H3/t13-,14-,16-,17+,18-,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H24O9
Molecular Weight 408.3992
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Suksdorfin: an anti-HIV principle from Lomatium suksdorfii, its structure-activity correlation with related coumarins, and synergistic effects with anti-AIDS nucleosides.
1994 Oct
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:59:06 GMT 2023
Edited
by admin
on Sat Dec 16 10:59:06 GMT 2023
Record UNII
S2KTH28M3N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NODAKENIN
MI  
Common Name English
(+)-MARMESININ
Common Name English
NODAKENIN, (+)-
Common Name English
2-(1-(.BETA.-D-GLUCOPYRANOSYLOXY)-1-METHYLETHYL)-2,3-DIHYDRO-7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE
Systematic Name English
7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE, 2-(1-(.BETA.-D-GLUCOPYRANOSYLOXY)-1-METHYLETHYL)-2,3-DIHYDRO-, (2R)-
Systematic Name English
NODAKENIN [MI]
Common Name English
NODAKENETIN, .BETA.-D-GLUCOPYRANOSIDE
Common Name English
Code System Code Type Description
PUBCHEM
73191
Created by admin on Sat Dec 16 10:59:06 GMT 2023 , Edited by admin on Sat Dec 16 10:59:06 GMT 2023
PRIMARY
CAS
495-31-8
Created by admin on Sat Dec 16 10:59:06 GMT 2023 , Edited by admin on Sat Dec 16 10:59:06 GMT 2023
PRIMARY
FDA UNII
S2KTH28M3N
Created by admin on Sat Dec 16 10:59:06 GMT 2023 , Edited by admin on Sat Dec 16 10:59:06 GMT 2023
PRIMARY
MERCK INDEX
m8025
Created by admin on Sat Dec 16 10:59:06 GMT 2023 , Edited by admin on Sat Dec 16 10:59:06 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID601318602
Created by admin on Sat Dec 16 10:59:06 GMT 2023 , Edited by admin on Sat Dec 16 10:59:06 GMT 2023
PRIMARY