Petrosamine
AlkaPlorer ID: AK151518
Synonym: None
IUPAC Name: None
Structure
SMILES: C[N+]1=CC=C2C(=C1)C(O)=C1C3=C(C(=O)C[N+]1(C)C)C1=CC=C(Br)C=C1N=C32
InChI: InChI=1S/C21H17BrN3O2/c1-24-7-6-12-14(9-24)21(27)20-18-17(16(26)10-25(20,2)3)13-5-4-11(22)8-15(13)23-19(12)18/h4-9H,10H2,1-3H3/q+1/p+1
InChIKey: ZIWIGKBGIBUCJC-UHFFFAOYSA-O
Reference
Petrosamine, a novel pigment from the marine sponge Petrosia sp
LOTUS: LTS0173125
SuperNatural Ⅲ: SN0471564
COCONUT: CNP0318986
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Petrosia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 424.298
TPSA？: 54.07
MolLogP？: 3.597000000000002
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|