ENDOCROCIN

CC1=C(C(O)=O)C(O)=C2C(=O)C3=C(C=C(O)C=C3O)C(=O)C2=C1

InChIKey=UZOHDKGTYVTYDZ-UHFFFAOYSA-N

InChI=1S/C16H10O7/c1-5-2-7-12(14(20)10(5)16(22)23)15(21)11-8(13(7)19)3-6(17)4-9(11)18/h2-4,17-18,20H,1H3,(H,22,23)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Targets

Primary Target	Pharmacology	Condition	Potency
Cyclooxygenase-2 196 Target ID: CHEMBL230 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20379952	Inhibitor 8297		25.76 µM [IC50]
Cyclooxygenase-1 127 Target ID: CHEMBL221 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20379952	Inhibitor 8297		40.02 µM [IC50]

PubMed

Title	Date	PubMed
Biosynthetic relationships among the secalonic acids. Isolation of emodin, endocrocin and secalonic acids from Pyrenochaeta terrestris and Aspergillus aculeatus.	1979 Dec	541252
Two-dimensional TLC separation and mass spectrometric identification of anthraquinones isolated from the fungus Dermocybe sanguinea.	2000 Mar-Apr	10817208
Endocrocin and its derivatives from the Japanese mealybug Planococcus kraunhiae.	2011	21512234
Identification of the antiphagocytic trypacidin gene cluster in the human-pathogenic fungus Aspergillus fumigatus.	2015 Dec	26278536

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:36:50 GMT 2023` Edited by `admin` on `Sat Dec 16 08:36:50 GMT 2023`
Record UNII	N1OEA1S070
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

ENDOCROCIN

Common Name

English

2-ANTHRACENECARBOXYLIC ACID, 9,10-DIHYDRO-1,6,8-TRIHYDROXY-3-METHYL-9,10-DIOXO-

Systematic Name

English

9,10-DIHYDRO-1,6,8-TRIHYDROXY-3-METHYL-9,10-DIOXO-2-ANTHRACENECARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

CHEBI

64450