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Preferred Name

7-Benzylidenenaltrexone
Synonyms

BNTX
ID

http://purl.obolibrary.org/obo/CHEBI_138855
charge

0
database_cross_reference

KEGG:C20167
formula

C27H27NO4
has_obo_namespace

chebi_ontology
has_related_synonym

BNTX
id

CHEBI:138855
in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR
inchi

InChI=1S/C27H27NO4/c29-20-9-8-18-13-21-27(31)14-19(12-16-4-2-1-3-5-16)23(30)25-26(27,22(18)24(20)32-25)10-11-28(21)15-17-6-7-17/h1-5,8-9,12,17,21,25,29,31H,6-7,10-11,13-15H2/b19-12+/t21-,25+,26+,27-/m1/s1
inchikey

WXOUFNFMPVMGFZ-BDQAUFNLSA-N
label

7-Benzylidenenaltrexone
mass

429.509
monoisotopicmass

429.19401
notation

CHEBI:138855
prefLabel

7-Benzylidenenaltrexone
smiles

[C@H]12C(/C(/C[C@@]3([C@@]14C=5C(C[C@H]3N(CC4)CC6CC6)=CC=C(C5O2)O)O)=C/C7=CC=CC=C7)=O
treeView

http://purl.obolibrary.org/obo/CHEBI_25961
subClassOf

http://purl.obolibrary.org/obo/CHEBI_25961
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http://purl.bioontology.org/ontology/MESH/C077358 Medical Subject Headings / 医学主题词表 LOOM