Preferred Name

Methacycline hydrochloride

Synonyms

Methacycline hydrochloride

ID

http://purl.obolibrary.org/obo/CHEBI_6806

charge

0

database_cross_reference

KEGG:D00849

KEGG:C08029

CAS:3963-95-9

formula

C22H22N2O8.HCl

has_exact_synonym

Methacycline hydrochloride

has_obo_namespace

chebi_ontology

id

CHEBI:6806

in_subset

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

inchi

InChI=1S/C22H22N2O8.ClH/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h4-6,10,14-15,17,25,27-29,32H,1H2,2-3H3,(H2,23,31);1H/t10-,14-,15+,17+,22+;/m1./s1

inchikey

VZQARNDJLLWXGL-CCHMMTNSSA-N

label

Methacycline hydrochloride

mass

478.880

monoisotopicmass

478.11429

notation

CHEBI:6806

prefLabel

Methacycline hydrochloride

smiles

Cl.CN(C)[C@H]1[C@@H]2[C@@H](O)[C@@H]3C(=C)c4cccc(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O

treeView

http://purl.obolibrary.org/obo/CHEBI_50860

subClassOf

http://purl.obolibrary.org/obo/CHEBI_50860

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http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C47608 National Cancer Institute Thesaurus / 美国国家癌症研究所词典 LOOM