2-Amino-1,3,4-octadecanetriol; (2ξ,3ξ,4ξ)-form, N-Tricosanoyl, 1-O-β-D-glucopyranoside
AlkaPlorer ID: AK286774
Synonym: Cornutaglycolipid
IUPAC Name: N-[3,4-dihydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadecan-2-yl]tricosanamide
Structure
SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCC
InChI: InChI=1S/C47H93NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-42(51)48-39(38-56-47-46(55)45(54)44(53)41(37-49)57-47)43(52)40(50)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h39-41,43-47,49-50,52-55H,3-38H2,1-2H3,(H,48,51)
InChIKey: IABKDQIULIWEIW-UHFFFAOYSA-N
Reference
CAS: 119830-12-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ilex cornuta | Ilex | Aquifoliaceae | Aquifoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 816.2589999999996
TPSA？: 168.94
MolLogP？: 9.312700000000008
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|