Clavatadine E
AlkaPlorer ID: AK059795
Synonym: ''
IUPAC Name: 3-(3-bromo-4-hydroxyphenyl)-N-[4-(diaminomethylideneamino)butyl]-2-hydroxyiminopropanamide
Structure
SMILES: N=C(N)NCCCCNC(=O)C(CC1=CC=C(O)C(Br)=C1)=NO
InChI: InChI=1S/C14H20BrN5O3/c15-10-7-9(3-4-12(10)21)8-11(20-23)13(22)18-5-1-2-6-19-14(16)17/h3-4,7,21,23H,1-2,5-6,8H2,(H,18,22)(H4,16,17,19)
InChIKey: FHRJNEDPVPOFPW-UHFFFAOYSA-N
Reference
Clavatadines C−E, Guanidine Alkaloids from the Australian Sponge <i>Suberea clavata</i>
PubChem CID: 74932385
CAS: 1152092-58-4
LOTUS: LTS0246519
COCONUT: CNP0306310
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Suberea clavata | Suberea | Aplysinellidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 386.25
TPSA？: 143.82
MolLogP？: 0.9068699999999998
Number of H-Donors: 6
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|