Icos#3
AlkaPlorer ID: AK320108
Synonym: None
IUPAC Name: 9-[3-hydroxy-5-(1H-indole-3-carbonyloxy)-6-methyloxan-2-yl]oxynon-2-enoic acid
Structure
SMILES: CC1OC(OCCCCCCC=CC(=O)O)C(O)CC1OC(=O)C1=CNC2=CC=CC=C12
InChI: InChI=1S/C24H31NO7/c1-16-21(32-23(29)18-15-25-19-11-8-7-10-17(18)19)14-20(26)24(31-16)30-13-9-5-3-2-4-6-12-22(27)28/h6-8,10-12,15-16,20-21,24-26H,2-5,9,13-14H2,1H3,(H,27,28)
InChIKey: XQKLJTSTLMVZHF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | Caenorhabditis | Rhabditidae | Rhabditida | Chromadorea | Nematoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 445.51200000000017
TPSA？: 118.08
MolLogP？: 3.7970000000000015
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|