2-Amino-8-pentadecene-1,3,4-triol; (2S,3S,4R,8E)-form, N-(2R-Hydroxyheptacosanoyl)
AlkaPlorer ID: AK287016
Synonym: None
IUPAC Name: 2-hydroxy-N-[(E)-1,3,4-trihydroxypentadec-8-en-2-yl]heptacosanamide
Structure
SMILES: CCCCCC/C=C/CCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCCCCCCC
InChI: InChI=1S/C42H83NO5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-12-10-8-6-4-2/h27,29,38-41,44-47H,3-26,28,30-37H2,1-2H3,(H,43,48)/b29-27+
InChIKey: JVJBYXLARDDLIU-ORIPQNMZSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ligusticum chuanxiong | Ligusticum | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 682.1279999999997
TPSA？: 110.02
MolLogP？: 10.625399999999996
Number of H-Donors: 5
Number of H-Acceptors: 5
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|