N-[(4E,14E)-3-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,14-dien-2-yl]docosanamide

AlkaPlorer ID: AK321225

Synonym: None

IUPAC Name: N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,14-dien-2-yl]docosanamide

Structure

SMILES: CCCC=CCCCCCCCCC=CC(O)C(COC1OC(CO)C(O)C(O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C46H87NO8/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-42(50)47-39(38-54-46-45(53)44(52)43(51)41(37-48)55-46)40(49)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h8,10,33,35,39-41,43-46,48-49,51-53H,3-7,9,11-32,34,36-38H2,1-2H3,(H,47,50)

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InChIKey: BZVOAOVDSULRAB-UHFFFAOYSA-N

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Reference

PubChem CID: 75964080

COCONUT: CNP0183831.2

Source

Species Genus Family Order Class Phylum Kingdom Domain
Calanus helgolandicus Calanus Calanidae Calanoida Hexanauplia Arthropoda Metazoa Eukaryota

Properties Information

Molecule Weight: 782.2009999999989

TPSA: 148.71

MolLogP: 9.503800000000004

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information