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

AlkaPlorer ID: AK286894

Synonym: None

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

Structure

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

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InChI: InChI=1S/C44H87NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-42(48)44(50)45-40(39-46)43(49)41(47)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h29,31,40-43,46-49H,3-28,30,32-39H2,1-2H3,(H,45,50)/b31-29+

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InChIKey: KRLRTEPRANCGSV-OWWNRXNESA-N

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Reference

PubChem CID: 138196780

CAS: 864086-03-3

Properties Information

Molecule Weight: 710.1819999999996

TPSA: 110.02

MolLogP: 11.405599999999993

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