Aplysinopsin; N1-Propanoyl
AlkaPlorer ID: AK289029
Synonym: N1-Propionylaplysinopsin
IUPAC Name: (5E)-2-imino-1,3-dimethyl-5-[(1-propanoylindol-3-yl)methylidene]imidazolidin-4-one
Structure
SMILES: CCC(=O)N1C=C(/C=C2\C(=O)N(C)C(=N)N2C)C2=CC=CC=C21
InChI: InChI=1S/C17H18N4O2/c1-4-15(22)21-10-11(12-7-5-6-8-13(12)21)9-14-16(23)20(3)17(18)19(14)2/h5-10,18H,4H2,1-3H3/b14-9+,18-17?
InChIKey: KEQDLRHDLIFHQI-HOPRWRRZSA-N
Reference
Chemical diversity in the scleractinian coral Astroides calycularis
PubChem CID: 23426566
CAS: 100667-70-7
LOTUS: LTS0017870
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Astroides calycularis | Astroides | Dendrophylliidae | Scleractinia | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 310.357
TPSA？: 69.39999999999999
MolLogP？: 2.3709700000000007
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|