Jaspamycin
AlkaPlorer ID: AK135896
Synonym: None
IUPAC Name: 7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Structure
SMILES: N#CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C2=C1C(O)=NC=N2
InChI: InChI=1S/C12H12N4O5/c13-1-5-2-16(10-7(5)11(20)15-4-14-10)12-9(19)8(18)6(3-17)21-12/h2,4,6,8-9,12,17-19H,3H2,(H,14,15,20)/t6-,8-,9-,12-/m1/s1
InChIKey: SKDKFLFSBDYEDO-WOUKDFQISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Jaspis splendens | Jaspis | Ancorinidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 292.251
TPSA？: 144.65000000000003
MolLogP？: -1.3799200000000005
Number of H-Donors: 4
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Tubulin alpha | Activity | None | None | 10.1021/acs.jnatprod.5b00987 |
| None | Unchecked | Activity | None | None | 10.1021/acs.jnatprod.5b00987 |