Pseudoceratinine C
AlkaPlorer ID: AK311465
Synonym: None
IUPAC Name: N-[3-[4-[2-amino-3-[2-(2-amino-1H-imidazol-5-yl)ethylamino]-3-oxopropyl]-2,6-dibromophenoxy]propyl]-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide
Structure
SMILES: COC1=C(Br)C(O)C2(C=C1Br)CC(C(=O)NCCCOC1=C(Br)C=C(CC(N)C(=O)NCCC3=CNC(N)=N3)C=C1Br)=NO2
InChI: InChI=1S/C27H31Br4N7O6/c1-42-22-17(30)10-27(23(39)20(22)31)11-19(38-44-27)25(41)34-4-2-6-43-21-15(28)7-13(8-16(21)29)9-18(32)24(40)35-5-3-14-12-36-26(33)37-14/h7-8,10,12,18,23,39H,2-6,9,11,32H2,1H3,(H,34,41)(H,35,40)(H3,33,36,37)
InChIKey: AMHPLTQUBLUGOB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudoceratina verrucosa | Pseudoceratina | Pseudoceratinidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 869.2039999999996
TPSA？: 199.2
MolLogP？: 3.052
Number of H-Donors: 6
Number of H-Acceptors: 10
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|