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butirosin A

MNXM730925 is deprecated and here replaced by MNXM1107934
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1107934

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

formula

C₂₁H₄₁N₅O₁₂

charge

mass

555.27517

reference

chebi:65112

InChIKey

XEQLFNPSYWZPOW-SVRMBHBBSA-N

InChI

InChI=1S/C21H41N5O12/c22-2-1-8(28)19(34)26-7-3-6(24)17(37-20-11(25)15(32)13(30)9(4-23)35-20)18(12(7)29)38-21-16(33)14(31)10(5-27)36-21/h6-18,20-21,27-33H,1-5,22-25H2,(H,26,34)/t6-,7+,8-,9+,10+,11+,12-,13+,14-,15+,16+,17+,18+,20+,21-/m0/s1

SMILES

NCC[C@H](O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:65112 chebi:65112	butirosin A (2S)-4-amino-N-[(1R,2S,3R,4R,5S)-5-amino-4-[(2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl)oxy]-2-hydroxy-3-(beta-D-xylofuranosyloxy)cyclohexyl]-2-hydroxybutanamide Ambutyrosin A Butyrosin A
sabiork.compound:26296 sabiorkM:26296 kegg.compound:C17585 keggC:C17585	Butirosin A
seed.compound:cpd17706 seedM:cpd17706	Butirosin A butirosin A
metacyc.compound:CPD-14140 metacycM:CPD-14140	butirosin A
keggC:M_C17585 seedM:M_cpd17706	secondary/obsolete/fantasy identifier