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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20O6
Molecular Weight 308.3264
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4'-HYDROXYCLADOSPORIN

SMILES

C[C@H]1C[C@@H](O)C[C@H](C[C@H]2CC3=C(C(=O)O2)C(O)=CC(O)=C3)O1

InChI

InChIKey=BGBCTXXTDYWYHE-VVUYAAESSA-N
InChI=1S/C16H20O6/c1-8-2-10(17)5-13(21-8)7-12-4-9-3-11(18)6-14(19)15(9)16(20)22-12/h3,6,8,10,12-13,17-19H,2,4-5,7H2,1H3/t8-,10+,12+,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H20O6
Molecular Weight 308.3264
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:47:46 GMT 2025
Edited
by admin
on Mon Mar 31 22:47:46 GMT 2025
Record UNII
2WMQ2799OP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4'-HYDROXYCLADOSPORIN
Common Name English
4'-HYDROXYASPERENTIN
Preferred Name English
1H-2-BENZOPYRAN-1-ONE, 3,4-DIHYDRO-6,8-DIHYDROXY-3-(((2R,4R,6S)-TETRAHYDRO-4-HYDROXY-6-METHYL-2H-PYRAN-2-YL)METHYL)-, (3R)-
Systematic Name English
(3R)-3,4-DIHYDRO-6,8-DIHYDROXY-3-(((2R,4R,6S)-TETRAHYDRO-4-HYDROXY-6-METHYL-2H-PYRAN-2-YL)METHYL)-1H-2-BENZOPYRAN-1-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50965812
Created by admin on Mon Mar 31 22:47:46 GMT 2025 , Edited by admin on Mon Mar 31 22:47:46 GMT 2025
PRIMARY
FDA UNII
2WMQ2799OP
Created by admin on Mon Mar 31 22:47:46 GMT 2025 , Edited by admin on Mon Mar 31 22:47:46 GMT 2025
PRIMARY
CAS
51484-09-4
Created by admin on Mon Mar 31 22:47:46 GMT 2025 , Edited by admin on Mon Mar 31 22:47:46 GMT 2025
PRIMARY
PUBCHEM
119057372
Created by admin on Mon Mar 31 22:47:46 GMT 2025 , Edited by admin on Mon Mar 31 22:47:46 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MINOR