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2'-N-acetylparomamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM9740

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₄H₂₉N₃O₈

charge

mass

367.399

reference

chebi:65010

InChIKey

ARLIVUJSSKFVPL-JPYLPOILSA-P

InChI

InChI=1S/C14H27N3O8/c1-4(19)17-8-11(22)10(21)7(3-18)24-14(8)25-13-6(16)2-5(15)9(20)12(13)23/h5-14,18,20-23H,2-3,15-16H2,1H3,(H,17,19)/p+2/t5-,6+,7-,8-,9+,10-,11-,12-,13-,14-/m1/s1

SMILES

[CH3:1][C:4](=[N:17][C@@H:8]1[C@@H:11]([OH:22])[C@H:10]([OH:21])[C@@H:7]([CH2:3][OH:18])[O:24][C@@H:14]1[O:25][C@@H:13]1[C@@H:6]([NH2:16])[CH2:2][C@@H:5]([NH2:15])[C@H:9]([OH:20])[C@H:12]1[OH:23])[OH:19]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:65010 chebi:65010	2'-N-acetylparomamine (1R,3S,4R,5R,6S)-4-[(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)oxy]-5,6-dihydroxycyclohexane-1,3-diaminium 2'-N-acetylparomamine(2+)
kegg.compound:C17582 keggC:C17582	2'-N-Acetylparomamine
seed.compound:cpd17703 seedM:cpd17703	2'-N-Acetylparomamine 2'-N-acetylparomamine
metacyc.compound:CPD-14126 metacycM:CPD-14126	2'-N-acetylparomamine
CHEBI:65018 chebi:65018	2'-N-acetylparomamine (1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
keggC:M_C17582 seedM:M_cpd17703	secondary/obsolete/fantasy identifier