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7-Chloro-6-demethylcepharadione B

Properties

Image

Occurences in reactions

MNX_ID

MNXM118531

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

formula

C₁₈H₁₂ClNO₄

charge

mass

341.04549

reference

InChIKey

DBNFUUYMTAGFDM-UHFFFAOYSA-N

InChI

InChI=1S/C18H12ClNO4/c1-23-11-7-10-12-13(17(11)24-2)8-5-3-4-6-9(8)14(19)15(12)20-18(22)16(10)21/h3-7H,1-2H3,(H,20,22)

SMILES

COc1cc2c3c(c(Cl)c4ccccc4c3c1OC)NC(=O)C2=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0039757	7-Chloro-6-demethylcepharadione B 8-chloro-15,16-dimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,8,13,15-heptaene-11,12-dione Gala-(1-4)-gala-(1-4)-gala Trigalacturonic acid a-D-Galactopyranuronosyl-(1->4)-a-D-galactopyranuronosyl-(1->4)-D-galacturonate a-D-Galactopyranuronosyl-(1->4)-a-D-galactopyranuronosyl-(1->4)-D-galacturonic acid alpha-D-Galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-D-galacturonate alpha-D-galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-D-galacturonate alpha-D-galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-D-galacturonic acid alpha-Gala-gala-gala
hmdb:HMDB39757	secondary/obsolete/fantasy identifier