(2R,3E)-N-((2S,3R,4E,8E,10E)-1,3-dihydroxyoctadeca-4,8,10-trien-2-yl)-2-hydroxy-6-methyloctadec-3-enimidic acid
AlkaPlorer ID: AK094256
Synonym: None
IUPAC Name: (E,2R)-N-[(2S,3R,4E,8E,10E)-1,3-dihydroxyoctadeca-4,8,10-trien-2-yl]-2-hydroxy-6-methyloctadec-3-enamide
Structure
SMILES: CCCCCCC/C=C/C=C/CC/C=C/[C@@H](O)[C@H](CO)N=C(O)[C@H](O)/C=C/CC(C)CCCCCCCCCCCC
InChI: InChI=1S/C37H67NO4/c1-4-6-8-10-12-14-16-17-18-20-22-24-26-30-35(40)34(32-39)38-37(42)36(41)31-27-29-33(3)28-25-23-21-19-15-13-11-9-7-5-2/h16-18,20,26-27,30-31,33-36,39-41H,4-15,19,21-25,28-29,32H2,1-3H3,(H,38,42)/b17-16+,20-18+,30-26+,31-27+/t33?,34-,35+,36+/m0/s1
InChIKey: BHSPRQAUQGDECT-WJTHWUQFSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Coolia monotis | Coolia | Ostreopsidaceae | Peridiniales | Dinophyceae | None | None | Eukaryota |
Properties Information
Molecule Weight: 589.946
TPSA？: 93.28
MolLogP？: 9.7283
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|