1,2,9-Trihydroxydibenz[cd,f]indol-4(5H)-one; 1,2-Di-Me ether
AlkaPlorer ID: AK019332
Synonym: Goniothalactam
IUPAC Name: 4-hydroxy-14,15-dimethoxy-10-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1,3,5,7,9(16),12,14-heptaen-11-one
Structure
SMILES: COC1=CC2=C3C(=CC4=CC=C(O)C=C4C3=C1OC)N=C2O
InChI: InChI=1S/C17H13NO4/c1-21-13-7-11-14-12(18-17(11)20)5-8-3-4-9(19)6-10(8)15(14)16(13)22-2/h3-7,19H,1-2H3,(H,18,20)
InChIKey: UDPCZNQWXHKYPJ-UHFFFAOYSA-N
Reference
Alkaloids from the Leaves of <i>Fissistigma Glaucescens</i>
PubChem CID: 10447198
CAS: 204975-46-2
LOTUS: LTS0178227
SuperNatural Ⅲ: SN0367595
NPASS: NPC215747
COCONUT: CNP0138271
data_source: manually
Source
Properties Information
Molecule Weight: 295.294
TPSA？: 71.28
MolLogP？: 3.6655000000000015
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | ADMET | CC50 | 100000.0 | nM | 10.1016/j.bmc.2006.10.034 |
| None | B-cell | IC50 | 100000.0 | nM | 10.1016/j.bmc.2006.10.034 |
| None | Platelet | Inhibition | 10.5 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 13.6 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 17.3 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 50.4 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 67.3 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 75.9 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 81.6 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 83.0 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 85.9 | % | 10.1021/np000063v |
| None | Platelet | Inhibition | 89.8 | % | 10.1021/np000063v |
| None | T-cell | IC50 | 100000.0 | nM | 10.1016/j.bmc.2006.10.034 |