Ambiguine B isonitrile
AlkaPlorer ID: AK284127
Synonym: A 89271C, Antibiotic A 89271C
IUPAC Name: 5-chloro-4-ethenyl-3-isocyano-4,8,8-trimethyl-15-(2-methylbut-3-en-2-yl)-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),9(16),10,12-tetraen-2-ol
Structure
SMILES: [C-]#[N+]C1C(C)(C=C)C(Cl)CC2C(C)(C)C3=C4C(=C(C(C)(C)C=C)NC4=CC=C3)C21O
InChI: InChI=1S/C26H31ClN2O/c1-9-23(3,4)21-20-19-15(12-11-13-16(19)29-21)24(5,6)17-14-18(27)25(7,10-2)22(28-8)26(17,20)30/h9-13,17-18,22,29-30H,1-2,14H2,3-7H3
InChIKey: XNSXDDHLEKKURV-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fischerella ambigua | Fischerella | Hapalosiphonaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 423.00000000000017
TPSA？: 40.38
MolLogP？: 6.217790000000008
Number of H-Donors: 2
Number of H-Acceptors: 1
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|