Barettin bromobenzisoxazolone
AlkaPlorer ID: AK290177
Synonym: Bromobenzisoxazolone Barettin
IUPAC Name: 2-[3-[5-[(6-bromo-1H-indol-3-yl)-(6-bromo-3-oxo-1H-2,1-benzoxazol-7-yl)-hydroxymethyl]-3,6-dioxopiperazin-2-yl]propyl]guanidine
Structure
SMILES: N=C(N)NCCCC1N=C(O)C(C(O)(C2=CNC3=CC(Br)=CC=C23)C2=C(Br)C=CC3=C2NOC3=O)N=C1O
InChI: InChI=1S/C24H23Br2N7O5/c25-10-3-4-11-13(9-30-16(11)8-10)24(37,17-14(26)6-5-12-18(17)33-38-22(12)36)19-21(35)31-15(20(34)32-19)2-1-7-29-23(27)28/h3-6,8-9,15,19,30,33,37H,1-2,7H2,(H,31,35)(H,32,34)(H4,27,28,29)
InChIKey: HHZVDLQSGVLYRE-UHFFFAOYSA-N
Reference
Antifouling Activity of a Dibrominated Cyclopeptide from the Marine Sponge <i>Geodia barretti</i>
PubChem CID: 138983182
LOTUS: LTS0067222
COCONUT: CNP0140402.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Geodia barretti | Geodia | Geodiidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 649.3000000000001
TPSA？: 209.1
MolLogP？: 3.290370000000002
Number of H-Donors: 8
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|