UNPD30885

AlkaPlorer ID: AK079274

Synonym: None

IUPAC Name: (2R)-2-hydroxy-N-[(2S,3S)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydocosa-4,13-dien-2-yl]tetradecanamide

Structure

SMILES: CCCCCCCCC=CCCCCCCCC=C[C@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCC

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InChI: InChI=1S/C42H79NO9/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-24-26-28-30-35(45)34(33-51-42-40(49)39(48)38(47)37(32-44)52-42)43-41(50)36(46)31-29-27-25-22-14-12-10-8-6-4-2/h16-17,28,30,34-40,42,44-49H,3-15,18-27,29,31-33H2,1-2H3,(H,43,50)/t34-,35-,36+,37+,38+,39-,40+,42+/m0/s1

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InChIKey: MOQQBSZILUXXBS-JAVALAMKSA-N

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Reference

PubChem CID: 162870332

NPASS: NPC127487

Properties Information

Molecule Weight: 742.0919999999994

TPSA: 168.94

MolLogP: 6.914200000000009

Number of H-Donors: 7

Number of H-Acceptors: 9

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information