Diazonamide B; Homologue (R = CH2CH3), debromo, 14-chloro
AlkaPlorer ID: AK295406
Synonym: Diazonamide D
IUPAC Name: 13-amino-10-butan-2-yl-3,26,35-trichloro-8,37,40-trioxa-4,11,22,34,39-pentazadecacyclo[27.6.1.12,5.16,9.115,19.118,21.07,20.020,24.023,28.033,36]tetraconta-1(35),2,4,6,9(39),15(38),16,18,23(28),24,26,29(36),30,32-tetradecaen-12-one
Structure
SMILES: CCC(C)C1NC(=O)C(N)CC2=CC=C3OC4NC5=C6C=C(Cl)C=C5C4(C3=C2)C2=C(N=C1O2)C1=NC(Cl)=C(O1)C1=C(Cl)NC2=CC=CC6=C12
InChI: InChI=1S/C36H27Cl3N6O4/c1-3-13(2)25-33-43-27-29(49-33)36-18-9-14(10-20(40)32(46)42-25)7-8-22(18)47-35(36)44-26-17(11-15(37)12-19(26)36)16-5-4-6-21-23(16)24(30(38)41-21)28-31(39)45-34(27)48-28/h4-9,11-13,20,25,35,41,44H,3,10,40H2,1-2H3,(H,42,46)
InChIKey: OCCVQKXIAJJTBD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Diazona | Diazonidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 714.009
TPSA？: 144.23
MolLogP？: 7.983700000000005
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|