Bioactive Compound Details

BioIDbio1989
Name9-AMINOCAMPTOTHECIN
ChEMBL IDCHEMBL274070
Molecular FormulaC20H17N3O4
Molecular Weight363.37
Molecular Weight (Monoisotopic)363.1219
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
Synonyms9-AMINO-20(S)-CAMPTOTHECIN|9-AMINOCAMPTOTHECIN|AMINOCAMPTOTHECIN|NSC-603071
SmilesCC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(N)cccc3nc2-1
InchiInChI=1S/C20H17N3O4/c1-2-20(26)13-7-16-17-10(6-11-14(21)4-3-5-15(11)22-17)8-23(16)18(24)12(13)9-27-19(20)25/h3-7,26H,2,8-9,21H2,1H3/t20-/m0/s1
Inchi KeyFUXVKZWTXQUGMW-FQEVSTJZSA-N
Molecular SpeciesNEUTRAL
Targets131.0
Bioactivities214.0
Np Likeness Score1.02
Records Key['5', '27', '2 (9-aminocamptothecin, 9-ACPT)', '5g', '21', '9-Aminocamptothecin', 'SID483848', '4', '9-aminocamptothecan', '9', 'SID26725257', '9-Aminocamptothecin', '9-aminocamptothecin', '2 (9-AC, 9-Amino Camptothecin)', '0603071:01', '2', '9-Aminocamptothecin', '9-AMINOCAMPTOTHECIN', '9-Aminocamptothecin', '9-Aminocamptothecin', '9-AMINOCAMPTOTHECIN', '9-aminocamptothecin', '9-aminocamptothecin', '9-aminocamptothecin']
Records Name['(S)-10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '(S)-10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '(20S)-10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '9-Aminocamptothecin', 'SID483848', '10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '9-aminocamptothecan', '9-Aminocamptothecin', 'SID26725257', '9-Aminocamptothecin', '10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '(S)-10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', 'CO-ADD:0137019', '(S)-10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', '9-Aminocamptothecin', '9-AMINOCAMPTOTHECIN', '9-Aminocamptothecin', '9-Aminocamptothecin', '9-AMINOCAMPTOTHECIN', '9-aminocamptothecin', '9-aminocamptothecin', '9-aminocamptothecin']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure