Clionamide; (S)-form
AlkaPlorer ID: AK292693
Synonym: None
IUPAC Name: 2-amino-3-(6-bromo-1H-indol-3-yl)-N-[(E)-2-(3,4,5-trihydroxyphenyl)ethenyl]propanamide
Structure
SMILES: NC(CC1=CNC2=CC(Br)=CC=C12)C(=O)N/C=C/C1=CC(O)=C(O)C(O)=C1
InChI: InChI=1S/C19H18BrN3O4/c20-12-1-2-13-11(9-23-15(13)8-12)7-14(21)19(27)22-4-3-10-5-16(24)18(26)17(25)6-10/h1-6,8-9,14,23-26H,7,21H2,(H,22,27)/b4-3+
InChIKey: YTHSWGAFCFXWGB-ONEGZZNKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cliona celata | Cliona | Clionaidae | Clionaida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 432.2740000000001
TPSA？: 131.6
MolLogP？: 2.7041000000000013
Number of H-Donors: 6
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|