Chejuenolide A
AlkaPlorer ID: AK080166
Synonym: None
IUPAC Name: N-[(1S,2E,4E,6R,8E,10E,12S,14E,17R)-6,12-dihydroxy-3,9,15,17-tetramethyl-16-oxocycloheptadeca-2,4,8,10,14-pentaen-1-yl]acetamide
Structure
SMILES: CC(O)=N[C@H]1/C=C(C)/C=C/[C@H](O)C/C=C(C)/C=C/[C@@H](O)C/C=C(\C)C(=O)[C@@H]1C
InChI: InChI=1S/C23H33NO4/c1-15-6-10-20(26)12-8-16(2)14-22(24-19(5)25)18(4)23(28)17(3)9-13-21(27)11-7-15/h6-9,11-12,14,18,20-22,26-27H,10,13H2,1-5H3,(H,24,25)/b11-7+,12-8+,15-6+,16-14+,17-9+/t18-,20-,21-,22+/m1/s1
InChIKey: UTURGGMCWRWPTG-YOFHZKFDSA-N
Reference
Chejuenolides A and B, new macrocyclic tetraenes from the marine bacterium Hahella chejuensis
PubChem CID: 25150198
LOTUS: LTS0271045
{NPAtlas: NPA015931
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hahella chejuensis | Hahella | Hahellaceae | Oceanospirillales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 387.52000000000015
TPSA？: 90.12
MolLogP？: 4.003500000000003
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|