Preferred Name |
camptothecin |
|
Synonyms |
|
|
Definitions |
A pyranoindolizinoquinoline that is pyrano[3',4':6,7]indolizino[1,2-b]quinoline which is substituted by oxo groups at positions 3 and 14, and by an ethyl group and a hydroxy group at position 4 (the S enantiomer). |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_27656 |
|
charge |
0 |
|
definition |
A pyranoindolizinoquinoline that is pyrano[3',4':6,7]indolizino[1,2-b]quinoline which is substituted by oxo groups at positions 3 and 14, and by an ethyl group and a hydroxy group at position 4 (the S enantiomer). |
|
formula |
C20H16N2O4 |
|
has role |
http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_76924 |
|
inchi |
InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3/t20-/m0/s1 |
|
inchikey |
VSJKWCGYPAHWDS-FQEVSTJZSA-N |
|
label |
camptothecin |
|
mass |
348.35200 |
|
monoisotopicmass |
348.11101 |
|
prefixIRI |
CHEBI:27656 |
|
prefLabel |
camptothecin |
|
smiles |
CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O |
|
subClassOf |
http://purl.obolibrary.org/obo/CHEBI_18946 http://purl.obolibrary.org/obo/CHEBI_48626 |