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deaminohydroxyblasticidin S

Properties

Image

Occurences in reactions

MNX_ID

MNXM4563

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

formula

C₁₇H₂₆N₇O₆

charge

mass

424.19391

reference

metacycM:DEAMINOHYDROXYBLASTICIDIN-S

InChIKey

REIIQZAQCCFGIJ-ZNIXKSQXSA-O

InChI

InChI=1S/C17H25N7O6/c1-23(16(19)20)6-4-9(18)8-12(26)21-10-2-3-13(30-14(10)15(27)28)24-7-5-11(25)22-17(24)29/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,19,20)(H,21,26)(H,27,28)(H,22,25,29)/p+1/t9-,10-,13+,14-/m0/s1

SMILES

CN(CC[C@H]([NH3+])CC(=O)N[C@H]1C=C[C@H](n2ccc(=O)[nH]c2=O)O[C@@H]1C(=O)[O-])C(N)=[NH2+]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:DEAMINOHYDROXYBLASTICIDIN-S metacycM:DEAMINOHYDROXYBLASTICIDIN-S	deaminohydroxyblasticidin S
kegg.compound:C03860 keggC:C03860	Deaminohydroxyblasticidin S
seed.compound:cpd02408 seedM:cpd02408	Deaminohydroxyblasticidin S deaminohydroxyblasticidin S
CHEBI:16251 chebi:16251	deaminohydroxyblasticidin S 1-{4-[3-amino-5-(N-methylcarbamimidamido)pentanamido]-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl}pyrimidine-2,4(1H,3H)-dione Deaminohydroxyblasticidin S Desaminohydroxyblasticidin-S
CHEBI:57697 chebi:57697	deaminohydroxyblasticidin S deaminohydroxyblasticidin S cation deaminohydroxyblasticidin S(1+)
chebi:14106 chebi:23568 chebi:4341 keggC:M_C03860 seedM:M_cpd02408	secondary/obsolete/fantasy identifier