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Unknown2

Properties

Image

Occurences in reactions

MNX_ID

MNXM22376

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	1

formula

C₁₁H₁₄ClNO₃

charge

mass

243.687

reference

InChIKey

IZPQESMSWSVMJJ-UHFFFAOYSA-N

InChI

InChI=1S/C11H14ClNO3/c1-8(7-14)11(15)13(16)6-9-4-2-3-5-10(9)12/h2-5,8,14,16H,6-7H2,1H3

SMILES

[CH3:1][CH:8]([CH2:7][OH:14])[C:11]([N:13]([CH2:6][c:9]1[cH:4][cH:2][cH:3][cH:5][c:10]1[Cl:12])[OH:16])=[O:15]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
envipath:...357be6286322 envipathM:...357be6286322 envipath:...2e1d47ccadd1 envipathM:...2e1d47ccadd1	Unknown2
bigg.metabolite:unk2_BS biggM:unk2_BS	Unknown 2
seed.compound:cpd15645 seedM:cpd15645	unknown 2 unk2_BS
biggM:M_unk2_BS seedM:M_cpd15645	secondary/obsolete/fantasy identifier