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

AlkaPlorer ID: AK286888

Synonym: None

IUPAC Name: N-[(E)-1,3,4-trihydroxyoctadec-8-en-2-yl]hexacosanamide

Structure

SMILES: CCCCCCCCC/C=C/CCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C44H87NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-43(48)45-41(40-46)44(49)42(47)38-36-34-32-30-28-16-14-12-10-8-6-4-2/h30,32,41-42,44,46-47,49H,3-29,31,33-40H2,1-2H3,(H,45,48)/b32-30+

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InChIKey: BNTSRXHBAPIDEL-NHQGMKOOSA-N

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Reference

PubChem CID: 138128529

CAS: 1101199-11-4

Source

Properties Information

Molecule Weight: 694.1829999999998

TPSA: 89.78999999999999

MolLogP: 12.434799999999983

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information