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carminomycin

Properties

Image

Occurences in reactions

MNX_ID

MNXM7151

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

formula

C₂₆H₂₈NO₁₀

charge

mass

514.17077

reference

chebi:75730

InChIKey

XREUEWVEMYWFFA-CSKJXFQVSA-O

InChI

InChI=1S/C26H27NO10/c1-9-21(30)13(27)6-16(36-9)37-15-8-26(35,10(2)28)7-12-18(15)25(34)20-19(23(12)32)22(31)11-4-3-5-14(29)17(11)24(20)33/h3-5,9,13,15-16,21,29-30,32,34-35H,6-8,27H2,1-2H3/p+1/t9-,13-,15-,16-,21+,26-/m0/s1

SMILES

CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:75730 chebi:75730	carminomycin (1S,3S)-3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-azaniumyl-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside carminomycin(1+)
kegg.compound:C12432 keggC:C12432	Carminomycin
seed.compound:cpd09184 seedM:cpd09184	Carminomycin carminomycin carubicin
CHEBI:31359 chebi:31359	carminomycin (1S,3S)-3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside CCRIS 961 Karminomycin O-Demethyldaunomycin carubicin
metacyc.compound:CPD-15734 metacycM:CPD-15734	carminomycin carubicin
keggC:M_C12432 seedM:M_cpd09184	secondary/obsolete/fantasy identifier