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N-(2,3-dihydroxybenzoyl)-L-serine trimer

Properties

Image

Occurences in reactions

MNX_ID

MNXM9396

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

formula

C₃₀H₂₈N₃O₁₆

charge

-1

mass

686.14751

reference

chebi:143020

InChIKey

NTWRWGRCGVKQNS-BZSNNMDCSA-M

InChI

InChI=1S/C30H29N3O16/c34-10-16(31-25(41)13-4-1-7-19(35)22(13)38)29(46)49-12-18(33-27(43)15-6-3-9-21(37)24(15)40)30(47)48-11-17(28(44)45)32-26(42)14-5-2-8-20(36)23(14)39/h1-9,16-18,34-40H,10-12H2,(H,31,41)(H,32,42)(H,33,43)(H,44,45)/p-1/t16-,17-,18-/m0/s1

SMILES

O=C(N[C@@H](COC(=O)[C@H](COC(=O)[C@H](CO)NC(=O)c1cccc(O)c1O)NC(=O)c1cccc(O)c1O)C(=O)[O-])c1cccc(O)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:143020 chebi:143020	N-(2,3-dihydroxybenzoyl)-L-serine trimer
seed.compound:cpd26520 seedM:cpd26520	(2,3-dihydroxybenzoylserine)3 N-(2,3-dihydroxybenzoyl)-L-serine trimer
kegg.compound:C22185 keggC:C22185	N-(2,3-Dihydroxybenzoyl)-L-serine trimer O-3-{O-3-[N-(2,3-dihydroxybenzoyl)-L-seryl]-N-(2,3-dihydroxybenzoyl)-L-seryl}-N-(2,3-dihydroxybenzoyl)-L-serine
metacyc.compound:CPD0-2483 metacycM:CPD0-2483	N-(2,3-dihydroxybenzoyl)-L-serine trimer (2,3-dihydroxybenzoylserine)3 O-3-{O-3-[N-(2,3-dihydroxybenzoyl)-L-seryl]-N-(2,3-dihydroxybenzoyl)-L-seryl}-N-(2,3-dihydroxybenzoyl)-L-serine
keggC:M_C22185 seedM:M_cpd26520	secondary/obsolete/fantasy identifier