CHEBI:183678 - 2-{[(9H-9-fluorenylmethoxy)carbonyl]amino}benzoic acid

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ChEBI Name 2-{[(9H-9-fluorenylmethoxy)carbonyl]amino}benzoic acid
ChEBI ID CHEBI:183678
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H17NO4
Net Charge 0
Average Mass 359.381
Monoisotopic Mass 359.11576
InChI InChI=1S/C22H17NO4/c24-21(25)18-11-5-6-12-20(18)23-22(26)27-13-19-16-9-3-1-7-14(16)15-8-2-4-10-17(15)19/h1-12,19H,13H2,(H,23,26)(H,24,25)
InChIKey CNAVPEPPAVHHKN-UHFFFAOYSA-N
SMILES O(CC1C=2C(C=3C1=CC=CC3)=CC=CC2)C(=O)NC=4C(=CC=CC4)C(O)=O
Metabolite of Species Details
Bombus terrestris (NCBI:txid30195) Found in hindgut (BTO:0000510). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in brain (BTO:0000142). See: MetaboLights Study
Roles Classification
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
(via fluorenes )
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ChEBI Ontology
Outgoing 2-{[(9H-9-fluorenylmethoxy)carbonyl]amino}benzoic acid (CHEBI:183678) is a fluorenes (CHEBI:24059)
IUPAC Name
2-(9H-luoren-9-ylmethoxycarbonylamino)benzoic acid
Manual Xref Database
848108 ChemSpider
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