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ECTO
Environmental Conditions, Treatments and Exposures Ontology
(ECTO)
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Last submission date April 10, 2024
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ID
http://purl.obolibrary.org/obo/CHEBI_4027
http://purl.obolibrary.org/obo/CHEBI_4027
https://agroportal.lirmm.fr/ontologies/ECTO/CHEBI_4027
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Preferred name
cyclophosphamide
Synonyms
N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide
(+-)-Cyclophosphamide
(RS)-Cyclophosphamide
Cyclophosphamide anhydrous
N,N-bis(2-chloroethyl)tetrahydro-2H-1,3,2-oxazaphosphorin-2-amine 2-oxide
2-[Bis(2-chloroethylamino)]-tetrahydro-2H-1,3,2-oxazaphosphorine-2-oxide
Bis(2-chloroethyl)phosphoramide cyclic propanolamide ester
Definitions
A phosphorodiamide that is 1,3,2-oxazaphosphinan-2-amine 2-oxide substituted by two 2-chloroethyl groups at the amino nitrogen atom.
Raw data
rdf:type
http://www.w3.org/2002/07/owl#Class
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rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_36683
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http://purl.obolibrary.org/obo/CHEBI_37598
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http://purl.obolibrary.org/obo/CHEBI_35467
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rdfs:label
cyclophosphamide
skos:notation
CHEBI:4027
obo_purl:IAO_0000115
A phosphorodiamide that is 1,3,2-oxazaphosphinan-2-amine 2-oxide substituted by two 2-chloroethyl groups at the amino nitrogen atom.
oboinowl_gen:hasExactSynonym
N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide
oboinowl_gen:hasDbXref
Beilstein:11744
CAS:50-18-0
DrugBank:DB00531
Drug_Central:758
HMDB:HMDB0014672
KEGG:C07888
KEGG:D07760
LINCS:LSM-4961
PMID:15711186
PMID:7850793
Reaxys:11744
Wikipedia:Cyclophosphamide
oboinowl_gen:hasOBONamespace
chebi_ontology
oboinowl_gen:id
CHEBI:4027
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
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oboinowl_gen:hasRelatedSynonym
(+-)-Cyclophosphamide
(RS)-Cyclophosphamide
Cyclophosphamide anhydrous
N,N-bis(2-chloroethyl)tetrahydro-2H-1,3,2-oxazaphosphorin-2-amine 2-oxide
2-[Bis(2-chloroethylamino)]-tetrahydro-2H-1,3,2-oxazaphosphorine-2-oxide
Bis(2-chloroethyl)phosphoramide cyclic propanolamide ester
obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_35610
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http://purl.obolibrary.org/obo/CHEBI_35703
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http://purl.obolibrary.org/obo/CHEBI_35705
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http://purl.obolibrary.org/obo/CHEBI_50903
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http://purl.obolibrary.org/obo/CHEBI_88188
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http://purl.obolibrary.org/obo/CHEBI_35842
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http://purl.obolibrary.org/obo/CHEBI_78298
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obo_purl:charge
0
obo_purl:formula
C7H15Cl2N2O2P
obo_purl:inchi
InChI=1S/C7H15Cl2N2O2P/c8-2-5-11(6-3-9)14(12)10-4-1-7-13-14/h1-7H2,(H,10,12)
obo_purl:inchikey
CMSMOCZEIVJLDB-UHFFFAOYSA-N
obo_purl:mass
261.08544
obo_purl:monoisotopicmass
260.02482
obo_purl:smiles
ClCCN(CCCl)P1(=O)NCCCO1
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