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erythromycin D

MNXM1557 is deprecated and here replaced by MNXM729710
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM729710

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₃₆H₆₆NO₁₂

charge

mass

704.45795

reference

chebi:63677

InChIKey

CLQUUOKNEOQBSW-KEGKUKQHSA-O

InChI

InChI=1S/C36H65NO12/c1-13-25-19(4)28(39)20(5)27(38)17(2)15-36(10,44)32(49-34-29(40)24(37(11)12)14-18(3)45-34)21(6)30(22(7)33(42)47-25)48-26-16-35(9,43)31(41)23(8)46-26/h17-26,28-32,34,39-41,43-44H,13-16H2,1-12H3/p+1/t17-,18-,19+,20+,21+,22-,23+,24+,25-,26+,28+,29-,30+,31+,32-,34+,35-,36-/m1/s1

SMILES

CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(O)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H]([NH+](C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@H]1C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:63677 chebi:63677	erythromycin D erythromycin D(+1) erythromycin D(1+)
kegg.compound:C06633 keggC:C06633	Erythromycin D
seed.compound:cpd04037 seedM:cpd04037	Erythromycin D erythromycin D
metacyc.compound:CPD-13806 metacycM:CPD-13806	erythromycin D
CHEBI:28331 chebi:28331	erythromycin D (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-4-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyloxy)-14-ethyl-7,12-dihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione Erythromycin D
chebi:23951 chebi:4844 keggC:M_C06633 seedM:M_cpd04037	secondary/obsolete/fantasy identifier