CHEBI:210083 - Aminoansamycin F

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Aminoansamycin F
ChEBI ID CHEBI:210083
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H22N2O6
Net Charge 0
Average Mass 422.437
Monoisotopic Mass 422.14779
InChI InChI=1S/C23H22N2O6/c1-13-20(27)10-4-2-3-8-18(24-17-9-6-5-7-15(17)23(30)31)16-11-14(26)12-19(21(16)28)25-22(13)29/h2-7,9-13,18,20,24,27H,8H2,1H3,(H,25,29)(H,30,31)/b3-2+,10-4+/t13-,18+,20-/m1/s1
InChIKey MPVQPROGFMSZBU-VFIWSIKLSA-N
SMILES O=C1NC=2C(=O)C(=CC(C2)=O)[C@@H](NC3=C(C(=O)O)C=CC=C3)CC=CC=C[C@H]([C@H]1C)O
Metabolite of Species Details
Streptomycesspecies S35 (NCBI:txid1456732) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Aminoansamycin F (CHEBI:210083) is a aminobenzoic acid (CHEBI:22495)
IUPAC Name
2-[[(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