3-amino-15-bromo-7-oxa-5-thia-8,18-diazatetracyclo[9.7.0.0²,?.0¹²,¹?]octadeca-1(11),12,14,16-tetraen-14-ol
AlkaPlorer ID: AK036956
Synonym: None
IUPAC Name: (2S,3S)-3-amino-15-bromo-7-oxa-5-thia-8,18-diazatetracyclo[9.7.0.02,8.012,17]octadeca-1(11),12,14,16-tetraen-14-ol
Structure
SMILES: N[C@@H]1CSCON2CCC3=C(NC4=CC(Br)=C(O)C=C34)[C@H]12
InChI: InChI=1S/C14H16BrN3O2S/c15-9-4-11-8(3-12(9)19)7-1-2-18-14(13(7)17-11)10(16)5-21-6-20-18/h3-4,10,14,17,19H,1-2,5-6,16H2/t10-,14+/m1/s1
InChIKey: XHYJPORPMFTSBP-YGRLFVJLSA-N
Reference
Eudistomins A-Q, .beta.-carbolines from the antiviral Caribbean tunicate Eudistoma olivaceum
PubChem CID: 184887
CAS: 88704-50-1
LOTUS: LTS0214911
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Eudistoma olivaceum | Eudistoma | Polycitoridae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 370.2720000000001
TPSA？: 74.51
MolLogP？: 2.4984
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|