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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H12O4
Molecular Weight 256.2534
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALOE EMODIN ANTHRONE

SMILES

OCC1=CC2=C(C(=O)C3=C(O)C=CC=C3C2)C(O)=C1

InChI

InChIKey=AVZIASIVCYCZND-UHFFFAOYSA-N
InChI=1S/C15H12O4/c16-7-8-4-10-6-9-2-1-3-11(17)13(9)15(19)14(10)12(18)5-8/h1-5,16-18H,6-7H2

HIDE SMILES / InChI

Approval Year

Name Type Language
ALOE EMODIN ANTHRONE
Common Name English
ANTHRONE, 1,8-DIHYDROXY-3-(HYDROXYMETHYL)-
Systematic Name English
9(10H)-ANTHRACENONE, 1,8-DIHYDROXY-3-(HYDROXYMETHYL)-
Systematic Name English
NSC-658578
Code English
1,8-DIHYDROXY-3-(HYDROXYMETHYL)ANTHRONE
Systematic Name English
1,8-DIHYDROXY-3-(HYDROXYMETHYL)-9(10H)-ANTHRACENONE
Systematic Name English
Code System Code Type Description
CAS
6247-99-0
Created by admin on Sat Dec 16 12:52:33 GMT 2023 , Edited by admin on Sat Dec 16 12:52:33 GMT 2023
PRIMARY
FDA UNII
J1GP8V92MP
Created by admin on Sat Dec 16 12:52:33 GMT 2023 , Edited by admin on Sat Dec 16 12:52:33 GMT 2023
PRIMARY
PUBCHEM
122840
Created by admin on Sat Dec 16 12:52:33 GMT 2023 , Edited by admin on Sat Dec 16 12:52:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID20211510
Created by admin on Sat Dec 16 12:52:33 GMT 2023 , Edited by admin on Sat Dec 16 12:52:33 GMT 2023
PRIMARY
NSC
658578
Created by admin on Sat Dec 16 12:52:33 GMT 2023 , Edited by admin on Sat Dec 16 12:52:33 GMT 2023
PRIMARY