Aminoansamycin G (CHEBI:210090)

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CHEBI:210090 - Aminoansamycin G

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ChEBI ID	CHEBI:210090
ChEBI Name	Aminoansamycin G
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H22N2O7
Net Charge	0
Average Mass	438.436
Monoisotopic Mass	438.14270
SMILES	C[C@H]1C(=O)NC2=CC(=O)C=C(C2=O)[C@@H](Nc2cc(O)cc(C(=O)O)c2)C/C=C/C=C/[C@H]1O
InChI	InChI=1S/C23H22N2O7/c1-12-20(28)6-4-2-3-5-18(24-14-7-13(23(31)32)8-15(26)9-14)17-10-16(27)11-19(21(17)29)25-22(12)30/h2-4,6-12,18,20,24,26,28H,5H2,1H3,(H,25,30)(H,31,32)/b3-2+,6-4+/t12-,18+,20-/m1/s1
InChIKey	HNKVTOIDORZILO-OQJWUKIDSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies S35 (ncbitaxon:1456732)	-	PubMed (31525059)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Aminoansamycin G (CHEBI:210090) is a hydroxybenzoic acid (CHEBI:24676)

IUPAC Name
3-hydroxy-5-[[(4R,5R,6E,8E,11S)-5-hydroxy-4-methyl-3,14,16-trioxo-2-azabicyclo[10.3.1]hexadeca-1(15),6,8,12-tetraen-11-yl]amino]benzoic acid