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emodin anthrone

Properties

Image

Occurences in reactions

MNX_ID

MNXM11486

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	1

formula

C₁₅H₁₂O₄

charge

mass

256.07356

reference

InChIKey

LAJSXCAVRQXZIO-UHFFFAOYSA-N

InChI

InChI=1S/C15H12O4/c1-7-2-8-4-9-5-10(16)6-12(18)14(9)15(19)13(8)11(17)3-7/h2-3,5-6,16-18H,4H2,1H3

SMILES

Cc1cc(O)c2c(c1)Cc1cc(O)cc(O)c1C2=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:150013 chebi:150013	emodin anthrone 1,3,8-trihydroxy-6-methylanthracen-9(10H)-one 1,3,8-trihydroxy-6-methylanthrone emodin-9-anthrone emodinanthrone
seed.compound:cpd25731 seedM:cpd25731	1,3,8-Trihydroxy-6-methylanthrone 1,3,8-trihydroxy-6-methylanthrone emodin anthrone emodinanthrone
hmdb:HMDB0036457	Emodinanthranol 1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone 1,3,8-Trihydroxy-6-methylanthrone 1,3,8-trihydroxy-6-methyl-10H-anthracen-9-one 1,3,8-trihydroxy-6-methyl-9,10-dihydroanthracen-9-one 1,6,8-Trihydroxy-3-methyl-10-hydroanthracen-9-one 6-Methyl-1,3,8,9-anthracenetetrol Emodin anthrone Emodinanthrone Emodinol Frangula emodin anthrone Frangulaemodinanthranol Frangulaemodinanthrone Protophyscihydrone
metacyc.compound:CPD-23474 metacycM:CPD-23474	emodin anthrone
metacyc.compound:CPD-9557 metacycM:CPD-9557	emodin anthrone 1,3,8-trihydroxy-6-methylanthrone emodinanthrone
hmdb:HMDB36457 seedM:M_cpd25731	secondary/obsolete/fantasy identifier