Cespilamide A
AlkaPlorer ID: AK291976
Synonym: None
IUPAC Name: 15-hydroxy-17,20,20-trimethyl-13-methylidene-2-oxa-5-azatetracyclo[8.8.2.01,5.07,19]icosa-7(19),16-dien-6-one
Structure
SMILES: C=C1CCC2CCC3=C(C2(C)C)C2(CC(C)=CC(O)C1)OCCN2C3=O
InChI: InChI=1S/C22H31NO3/c1-14-5-6-16-7-8-18-19(21(16,3)4)22(13-15(2)12-17(24)11-14)23(20(18)25)9-10-26-22/h12,16-17,24H,1,5-11,13H2,2-4H3
InChIKey: LOSUIZIXDPLWEQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Cespitularia | Xeniidae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 357.49400000000014
TPSA？: 49.77
MolLogP？: 3.7253000000000025
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|