2-Amino-1,3,4-octadecanetriol; (2ξ,3ξ,4ξ)-form, N-Pentacosanoyl, 1-O-β-D-glucopyranoside
AlkaPlorer ID: AK286773
Synonym: None
IUPAC Name: N-[3,4-dihydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadecan-2-yl]pentacosanamide
Structure
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCC(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCC
InChI: InChI=1S/C49H97NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-44(53)50-41(40-58-49-48(57)47(56)46(55)43(39-51)59-49)45(54)42(52)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h41-43,45-49,51-52,54-57H,3-40H2,1-2H3,(H,50,53)
InChIKey: JPIXJQQFSMROLE-UHFFFAOYSA-N
Reference
Glycolipids from Mirabilis himalaica
PubChem CID: 76837051
LOTUS: LTS0072470
COCONUT: CNP0247049.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mirabilis himalaica | Mirabilis | Nyctaginaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 844.3129999999996
TPSA？: 172.43
MolLogP？: 10.933199999999994
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|