Adechlorin
AlkaPlorer ID: AK005745
Synonym: None
IUPAC Name: (8R)-3-[(2R,3R,4R,5R)-3-chloro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol
Structure
SMILES: OC[C@H]1O[C@@H](N2C=NC3=C2NC=NC[C@H]3O)[C@H](Cl)[C@@H]1O
InChI: InChI=1S/C11H15ClN4O4/c12-7-9(19)6(2-17)20-11(7)16-4-15-8-5(18)1-13-3-14-10(8)16/h3-7,9,11,17-19H,1-2H2,(H,13,14)/t5-,6-,7-,9-,11-/m1/s1
InChIKey: JYWSHPMZFVPRRF-AMFMTJJISA-N
Reference
PubChem CID: 125913
CAS: 2224-10-4
LOTUS: LTS0103431
SuperNatural Ⅲ: SN0179058-04
{NPAtlas: NPA020877
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinomadura sp. | Actinomadura | Thermomonosporaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 302.718
TPSA？: 112.13
MolLogP？: -0.7717000000000007
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|