Dihomodehydrobatzelladine C
AlkaPlorer ID: AK295631
Synonym: Dehydrodihomobatzelladine C
IUPAC Name: 4-(diaminomethylideneamino)butyl 10-nonyl-6-pentyl-7,9,12-triazatricyclo[6.3.1.04,12]dodeca-4,6,8-triene-5-carboxylate
Structure
SMILES: CCCCCCCCCC1CC2CCC3=C(C(=O)OCCCCNC(=N)N)C(CCCCC)=NC(=N1)N32
InChI: InChI=1S/C29H50N6O2/c1-3-5-7-8-9-10-12-15-22-21-23-17-18-25-26(27(36)37-20-14-13-19-32-28(30)31)24(16-11-6-4-2)34-29(33-22)35(23)25/h22-23H,3-21H2,1-2H3,(H4,30,31,32)
InChIKey: PCOULOMMFNDLIU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Monanchora arbuscula | Monanchora | Crambeidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
| Clathria calla | Clathria | Microcionidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 514.7590000000004
TPSA？: 116.16
MolLogP？: 5.815270000000004
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|