Preferred Name | tritoqualine | |
Synonyms |
inhibostamin hypostamine tritocaline hypostamin |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_135802 |
|
alternative term |
inhibostamin hypostamine tritocaline hypostamin |
|
charge |
0 |
|
database_cross_reference |
CAS:14504-73-5 HMDB:HMDB0240249 Drug_Central:2765 |
|
formula |
C26H32N2O8 |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
inhibostamin hypostamine tritocaline hypostamin |
|
has_RxCUI |
38810 |
|
id |
CHEBI:135802 |
|
in_subset | ||
inchi |
InChI=1S/C26H32N2O8/c1-6-31-23-17-16(18(27)24(32-7-2)25(23)33-8-3)26(29)36-21(17)19-15-13(9-10-28(19)4)11-14-20(22(15)30-5)35-12-34-14/h11,19,21H,6-10,12,27H2,1-5H3 |
|
inchikey |
IRGJVQIJENCTQF-UHFFFAOYSA-N |
|
label |
tritoqualine |
|
mass |
500.542 |
|
monoisotopicmass |
500.21587 |
|
notation |
CHEBI:135802 |
|
prefixIRI |
CHEBI:135802 |
|
prefLabel |
tritoqualine |
|
smiles |
O(CC)C=1C=2C(OC(C2C(=C(C1OCC)OCC)N)=O)C3C=4C(OC)=C5C(=CC4CCN3C)OCO5 |
|
subClassOf |
Create mapping