None
AlkaPlorer ID: AK324917
Synonym: None
IUPAC Name: methyl (2E,4E)-9-hydroxy-10-[(2R,4R,6S)-6-[(S)-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]amino]-methoxymethyl]-4-methoxy-3,3-dimethyloxan-2-yl]deca-2,4-dienoate
Structure
SMILES: C=C1C[C@](OC)([C@H](O)C(O)=N[C@@H](OC)[C@@H]2C[C@@H](OC)C(C)(C)[C@@H](CC(O)CCC/C=C/C=C/C(=O)OC)O2)O[C@H](C)[C@@H]1C
InChI: InChI=1S/C32H53NO10/c1-20-19-32(41-9,43-22(3)21(20)2)28(36)29(37)33-30(40-8)24-18-25(38-6)31(4,5)26(42-24)17-23(34)15-13-11-10-12-14-16-27(35)39-7/h10,12,14,16,21-26,28,30,34,36H,1,11,13,15,17-19H2,2-9H3,(H,33,37)/b12-10+,16-14+/t21-,22-,23?,24+,25-,26-,28-,30+,32-/m1/s1
InChIKey: WEKFPWLLJSTWAY-LPLALOIHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trachycladus laevispirulifer | Trachycladus | Trachycladidae | Trachycladida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 611.7730000000004
TPSA？: 145.5
MolLogP？: 4.025500000000002
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Haemonchus contortus | Haemonchus contortus | LD99 | 2.6 | ug ml-1 | 10.1021/np000474b |
| Saccharomyces cerevisiae | Saccharomyces cerevisiae | LD99 | 5.2 | ug ml-1 | 10.1021/np000474b |