Molecule

Linckiacerebroside A

AlkaPlorer ID: AK073885

Synonym: '(+)-Linckiacerebroside A'

IUPAC Name: (2R)-N-[(2S,3S,4R)-3,4-dihydroxy-16-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptadecan-2-yl]-2-hydroxyhexadecanamide

Structure

SMILES: CCCCCCCCCCCCCC[C@@H](O)C(O)=N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCC(C)C

InChI: InChI=1S/C40H79NO10/c1-4-5-6-7-8-9-10-11-14-18-21-24-27-33(44)39(49)41-31(29-50-40-38(48)37(47)36(46)34(28-42)51-40)35(45)32(43)26-23-20-17-15-12-13-16-19-22-25-30(2)3/h30-38,40,42-48H,4-29H2,1-3H3,(H,41,49)/t31-,32+,33+,34+,35-,36+,37-,38+,40+/m0/s1

InChIKey: FQYGQINELNMLPB-LDIHZWHXSA-N

Reference

Biologically Active Glycosides from Asteroidea, 41. Isolation and Structure Determination of Glucocerebrosides from the Starfish Linckia laevigata

PubChem CID: 11679311

LOTUS: LTS0159392

SuperNatural Ⅲ: SN0093163-02

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Linckia laevigata	Linckia	Ophidiasteridae	Valvatida	Asteroidea	Echinodermata	Metazoa	Eukaryota

Properties Information

Molecule Weight: 734.0689999999994

TPSA？: 192.66

MolLogP？: 6.249000000000004

Number of H-Donors: 8

Number of H-Acceptors: 10

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi