2-Amino-8-tetradecene-1,3,4-triol; (2S,3S,4R,8E)-form, N-(2R-Hydroxydocosanoyl) 

AlkaPlorer ID: AK287490

Synonym: Leucoceramide C

IUPAC Name: 2-hydroxy-N-[(E)-1,3,4-trihydroxytetradec-8-en-2-yl]docosanamide

Structure

SMILES: CCCCC/C=C/CCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C36H71NO5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-26-28-30-34(40)36(42)37-32(31-38)35(41)33(39)29-27-25-23-12-10-8-6-4-2/h12,23,32-35,38-41H,3-11,13-22,24-31H2,1-2H3,(H,37,42)/b23-12+

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InChIKey: YNHSNYVSPLNTFQ-FSJBWODESA-N

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Reference

PubChem CID: 138306512

CAS: 903583-01-7

Source

Properties Information

Molecule Weight: 597.9660000000002

TPSA: 110.02

MolLogP: 8.284800000000008

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information