UNPD53798
AlkaPlorer ID: AK041843
Synonym: None
IUPAC Name: (3Z,5R,6S)-7,9-dibromo-3-[(5R,6S)-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-7,9-dien-3-ylidene]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-7,9-dien-6-ol
Structure
SMILES: COC1=C(Br)[C@@H](O)[C@]2(C=C1Br)C/C(=C1\C[C@]3(C=C(Br)C(OC)=C(Br)[C@H]3O)ON1)NO2
InChI: InChI=1S/C18H18Br4N2O6/c1-27-13-7(19)3-17(15(25)11(13)21)5-9(23-29-17)10-6-18(30-24-10)4-8(20)14(28-2)12(22)16(18)26/h3-4,15-16,23-26H,5-6H2,1-2H3/b10-9-/t15-,16-,17+,18+/m1/s1
InChIKey: MSUQRBGGMAYWIP-CUVJCVNXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudoceratina purpurea | Pseudoceratina | Pseudoceratinidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 677.9660000000003
TPSA？: 101.44
MolLogP？: 3.337800000000002
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|