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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H10O6
Molecular Weight 286.2363
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .OMEGA.-HYDROXYEMODIN

SMILES

OCC1=CC(O)=C2C(=O)C3=C(C=C(O)C=C3O)C(=O)C2=C1

InChI

InChIKey=YQHZABGPIPECSQ-UHFFFAOYSA-N
InChI=1S/C15H10O6/c16-5-6-1-8-12(10(18)2-6)15(21)13-9(14(8)20)3-7(17)4-11(13)19/h1-4,16-19H,5H2

HIDE SMILES / InChI

Molecular Formula C15H10O6
Molecular Weight 286.2363
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 Fri Dec 15 17:59:48 UTC 2023
Edited
by admin
on Fri Dec 15 17:59:48 UTC 2023
Record UNII
O2H2Z421AP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.OMEGA.-HYDROXYEMODIN
Common Name English
HYDROXYEMODIN
Common Name English
9,10-ANTHRACENEDIONE, 1,3,8-TRIHYDROXY-6-(HYDROXYMETHYL)-
Systematic Name English
NSC-624612
Code English
OMEGA-HYDROXYEMODIN
Common Name English
1,3,8-TRIHYDROXY-6-(HYDROXYMETHYL)ANTHRAQUINONE
Systematic Name English
HYDROXYEMODIN, .OMEGA.-
Common Name English
ANTHRAQUINONE, 1,3,8-TRIHYDROXY-6-(HYDROXYMETHYL)-
Systematic Name English
CITREOROSEIN
Common Name English
1,3,8-TRIHYDROXY-6-HYDROXYMETHYLANTHRAQUINONE
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Citreorosein
Created by admin on Fri Dec 15 17:59:48 UTC 2023 , Edited by admin on Fri Dec 15 17:59:48 UTC 2023
PRIMARY
FDA UNII
O2H2Z421AP
Created by admin on Fri Dec 15 17:59:48 UTC 2023 , Edited by admin on Fri Dec 15 17:59:48 UTC 2023
PRIMARY
EPA CompTox
DTXSID60197420
Created by admin on Fri Dec 15 17:59:48 UTC 2023 , Edited by admin on Fri Dec 15 17:59:48 UTC 2023
PRIMARY
NSC
624612
Created by admin on Fri Dec 15 17:59:48 UTC 2023 , Edited by admin on Fri Dec 15 17:59:48 UTC 2023
PRIMARY
CAS
481-73-2
Created by admin on Fri Dec 15 17:59:48 UTC 2023 , Edited by admin on Fri Dec 15 17:59:48 UTC 2023
PRIMARY
PUBCHEM
361512
Created by admin on Fri Dec 15 17:59:48 UTC 2023 , Edited by admin on Fri Dec 15 17:59:48 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
ACTIVE MOIETY