(1S,15R,16R,21S)-4,14,20-triazahexacyclo[13.6.2.0²,¹⁴.0³,¹¹.0⁵,¹⁰.0¹⁶,²¹]tricosa-2,4,6,8,10,12-hexaene
AlkaPlorer ID: AK150307
Synonym: None
IUPAC Name: (1S,15R,16R,21S)-4,14,20-triazahexacyclo[13.6.2.02,14.03,11.05,10.016,21]tricosa-2,4,6,8,10,12-hexaene
Structure
SMILES: C1=CC2=NC3=C4[C@H]5CC[C@H]([C@@H]6CCCN[C@@H]65)N4C=CC3=C2C=C1
InChI: InChI=1S/C20H21N3/c1-2-6-16-12(4-1)13-9-11-23-17-8-7-15(20(23)19(13)22-16)18-14(17)5-3-10-21-18/h1-2,4,6,9,11,14-15,17-18,21H,3,5,7-8,10H2/t14-,15-,17+,18-/m0/s1
InChIKey: JKCGCIXGXNBFNZ-ONIAQPFYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nitraria schoberi | Nitraria | Nitrariaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 303.40900000000005
TPSA？: 29.85
MolLogP？: 3.9414000000000025
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|