2-Amino-8-octadecene-1,3,4-triol; (2S,3S,4R,8E)-form, N-(2R-Hydroxypentacosanoyl)
AlkaPlorer ID: AK286897
Synonym: Gynuramide I
IUPAC Name: 2-hydroxy-N-[(E)-1,3,4-trihydroxyoctadec-8-en-2-yl]pentacosanamide
Structure
SMILES: CCCCCCCCC/C=C/CCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCCCCC
InChI: InChI=1S/C43H85NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(47)43(49)44-39(38-45)42(48)40(46)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h28,30,39-42,45-48H,3-27,29,31-38H2,1-2H3,(H,44,49)/b30-28+
InChIKey: PBLGRAOOBKNRGK-SJCQXOIGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Synurus deltoides | Synurus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Gynura japonica | Gynura | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 696.1549999999996
TPSA？: 110.02
MolLogP？: 11.015499999999996
Number of H-Donors: 5
Number of H-Acceptors: 5
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|