Molecule

UNPD108284

AlkaPlorer ID: AK088537

Synonym: None

IUPAC Name: (Z,2R)-N-[(2S,3S,4R)-3,4-dihydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptadecan-2-yl]-2-hydroxytetracos-15-enamide

Structure

SMILES: CCCCCCCC/C=C\CCCCCCCCCCCC[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)CCCCCCCCCCCCC

InChI: InChI=1S/C47H91NO10/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-35-40(51)46(56)48-38(37-57-47-45(55)44(54)43(53)41(36-49)58-47)42(52)39(50)34-32-30-28-26-24-14-12-10-8-6-4-2/h16-17,38-45,47,49-55H,3-15,18-37H2,1-2H3,(H,48,56)/b17-16-/t38-,39+,40+,41+,42-,43+,44-,45+,47+/m0/s1

InChIKey: KETZSAADPAEGGP-MGGPMQNPSA-N

Reference

Biologically active glycosides from asteroidea, XXVIII. Glycosphingolipids from the starfish <i>Asterias amurensis versicolor</i> Sladen, 1. Isolation and structure of six new cerebrosides, asteriacerebrosides AF, and two known cerebrosides, astrocerebroside A and acanthacerebroside C

PubChem CID: 15693327

LOTUS: LTS0179269

SuperNatural Ⅲ: SN0183683-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Asterias amurensis	Asterias	Asteriidae	Forcipulatida	Asteroidea	Echinodermata	Metazoa	Eukaryota

Properties Information

Molecule Weight: 830.2419999999997

TPSA？: 192.66

MolLogP？: 8.89980000000001

Number of H-Donors: 8

Number of H-Acceptors: 10

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi