22-benzyl-25-(butan-2-yl)-3-(2-methylpropyl)-12-(propan-2-yl)-1,4,10,13,19,23,26-heptaazatetracyclo[26.3.0.0?,¹?.0¹?,¹?]hentriacontane-2,5,11,14,21,24,27-heptone
AlkaPlorer ID: AK018871
Synonym: None
IUPAC Name: 22-benzyl-25-butan-2-yl-3-(2-methylpropyl)-12-propan-2-yl-1,4,10,13,19,23,26-heptazatetracyclo[26.3.0.06,10.015,19]hentriacontane-2,5,11,14,21,24,27-heptone
Structure
SMILES: CCC(C)C1N=C(O)C2CCCN2C(=O)C(CC(C)C)N=C(O)C2CCCN2C(=O)C(C(C)C)N=C(O)C2CCCN2CC(=O)C(CC2=CC=CC=C2)N=C1O
InChI: InChI=1S/C42H63N7O7/c1-7-27(6)36-40(54)43-29(23-28-14-9-8-10-15-28)34(50)24-47-19-11-16-31(47)37(51)45-35(26(4)5)42(56)49-21-13-17-32(49)38(52)44-30(22-25(2)3)41(55)48-20-12-18-33(48)39(53)46-36/h8-10,14-15,25-27,29-33,35-36H,7,11-13,16-24H2,1-6H3,(H,43,54)(H,44,52)(H,45,51)(H,46,53)
InChIKey: LVEJXBHPAHVYAJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Prosuberites laughlini | Prosuberites | Suberitidae | Suberitida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 778.0079999999999
TPSA？: 191.29
MolLogP？: 5.306800000000008
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|