(2R)-2-hydroxy-N-[(2R,3S,4R,12E)-1,3,4-trihydroxyhenicos-12-en-2-yl]docosanamide

AlkaPlorer ID: AK043216

Synonym: None

IUPAC Name: (2R)-2-hydroxy-N-[(E,2R,3S,4R)-1,3,4-trihydroxyhenicos-12-en-2-yl]docosanamide

Structure

SMILES: CCCCCCCC/C=C/CCCCCCC[C@@H](O)[C@@H](O)[C@@H](CO)N=C(O)[C@H](O)CCCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C43H85NO5/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-37-41(47)43(49)44-39(38-45)42(48)40(46)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h18,22,39-42,45-48H,3-17,19-21,23-38H2,1-2H3,(H,44,49)/b22-18+/t39-,40-,41-,42+/m1/s1

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InChIKey: IYVLMQOAMKLJKB-KXOUSRBYSA-N

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Source

Properties Information

Molecule Weight: 696.1549999999994

TPSA: 113.51

MolLogP: 11.85579999999999

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