Jiangrine C
AlkaPlorer ID: AK070095
Synonym: 'Jiangrine D', 'Jiangrine C'
IUPAC Name: 5-[(1S,2R)-2,3-dihydroxy-1-methoxypropyl]-1-[2-(4-hydroxyphenyl)ethyl]pyrrole-2-carbaldehyde
Structure
SMILES: CO[C@@H](C1=CC=C(C=O)N1CCC1=CC=C(O)C=C1)[C@H](O)CO
InChI: InChI=1S/C17H21NO5/c1-23-17(16(22)11-20)15-7-4-13(10-19)18(15)9-8-12-2-5-14(21)6-3-12/h2-7,10,16-17,20-22H,8-9,11H2,1H3/t16-,17+/m1/s1
InChIKey: BRXGBJMQZQFKJV-SJORKVTESA-N
Reference
Jiangrines A–F and Jiangolide from an Actinobacterium, <i>Jiangella gansuensis</i>
PubChem CID: 118722355
LOTUS: LTS0101349
NPASS: NPC472287
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Jiangella gansuensis | Jiangella | Jiangellaceae | Jiangellales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 319.357
TPSA？: 91.92
MolLogP？: 1.2896
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Mus musculus | RAW264.7 | Activity | nan | None | 10.1021/np500402a |
| Mus musculus | RAW264.7 | IC50 | 30100.0 | nM | 10.1021/np500402a |