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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H14O7
Molecular Weight 306.2675
Optical Activity ( - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Melacacidin, (-)-

SMILES

O[C@@H]1[C@H](O)C2=CC=C(O)C(O)=C2O[C@@H]1C3=CC(O)=C(O)C=C3

InChI

InChIKey=JEUXGAUBSWADEA-MRVWCRGKSA-N
InChI=1S/C15H14O7/c16-8-3-1-6(5-10(8)18)14-13(21)11(19)7-2-4-9(17)12(20)15(7)22-14/h1-5,11,13-14,16-21H/t11-,13-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H14O7
Molecular Weight 306.2675
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:05:15 GMT 2023
Edited
by admin
on Sat Dec 16 18:05:15 GMT 2023
Record UNII
M23MQJ2D23
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Melacacidin, (-)-
Common Name English
EPIMESQUITOL-4.ALPHA.-OL
Systematic Name English
(-)-Melacacidin
Common Name English
(2R,3R,4R)-2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-2H-1-BENZOPYRAN-3,4,7,8-TETROL
Systematic Name English
2H-1-BENZOPYRAN-3,4,7,8-TETROL, 2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-, (2R-(2.ALPHA.,3.ALPHA.,4.ALPHA.))-
Systematic Name English
MELACACIDIN
Common Name English
Code System Code Type Description
FDA UNII
M23MQJ2D23
Created by admin on Sat Dec 16 18:05:15 GMT 2023 , Edited by admin on Sat Dec 16 18:05:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID60959025
Created by admin on Sat Dec 16 18:05:15 GMT 2023 , Edited by admin on Sat Dec 16 18:05:15 GMT 2023
PRIMARY
WIKIPEDIA
Melacacidin
Created by admin on Sat Dec 16 18:05:15 GMT 2023 , Edited by admin on Sat Dec 16 18:05:15 GMT 2023
PRIMARY
PUBCHEM
169996
Created by admin on Sat Dec 16 18:05:15 GMT 2023 , Edited by admin on Sat Dec 16 18:05:15 GMT 2023
PRIMARY
CAS
38081-16-2
Created by admin on Sat Dec 16 18:05:15 GMT 2023 , Edited by admin on Sat Dec 16 18:05:15 GMT 2023
PRIMARY