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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H17NO5
Molecular Weight 363.3634
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-HYDROXYORCEIN

SMILES

CC1=CC(=O)C=C2OC3=CC(O)=C(C(C)=C3N=C12)C4=C(O)C=C(O)C=C4C

InChI

InChIKey=RAUFRXOSBVUCEA-UHFFFAOYSA-N
InChI=1S/C21H17NO5/c1-9-4-12(23)6-14(25)18(9)19-11(3)21-17(8-15(19)26)27-16-7-13(24)5-10(2)20(16)22-21/h4-8,23,25-26H,1-3H3

HIDE SMILES / InChI

Molecular Formula C21H17NO5
Molecular Weight 363.3634
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:30:45 GMT 2023
Edited
by admin
on Sat Dec 16 00:30:45 GMT 2023
Record UNII
7559OEW7RM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-HYDROXYORCEIN
Common Name English
Code System Code Type Description
FDA UNII
7559OEW7RM
Created by admin on Sat Dec 16 00:30:45 GMT 2023 , Edited by admin on Sat Dec 16 00:30:45 GMT 2023
PRIMARY
PUBCHEM
135405817
Created by admin on Sat Dec 16 00:30:45 GMT 2023 , Edited by admin on Sat Dec 16 00:30:45 GMT 2023
PRIMARY