α-Dehydrobiotin
AlkaPlorer ID: AK011308
Synonym: None
IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pent-2-enoic acid
Structure
SMILES: O=C(O)C=CCC[C@@H]1SC[C@@H]2N=C(O)N[C@@H]21
InChI: InChI=1S/C10H14N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h2,4,6-7,9H,1,3,5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1
InChIKey: NZERRTYPTPRCIR-ZKWXMUAHSA-N
Reference
Naturally Occurring Antimetabolite Antibiotic Related to Biotin
PubChem CID: 25449
LOTUS: LTS0145378
{NPAtlas: NPA007381
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces lydicus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 242.3
TPSA？: 81.92
MolLogP？: 0.7772000000000001
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|