(2R)-N-[(2R,3R,5R)-3,5-dihydroxy-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}nonadecan-2-yl]-2-hydroxytricosanamide

AlkaPlorer ID: AK174360

Synonym: None

IUPAC Name: (2R)-N-[(2R,3R,5R)-3,5-dihydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonadecan-2-yl]-2-hydroxytricosanamide

Structure

SMILES: CCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(O)=N[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)C[C@H](O)CCCCCCCCCCCCCC

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InChI: InChI=1S/C48H95NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-41(52)47(57)49-40(38-58-48-46(56)45(55)44(54)43(37-50)59-48)42(53)36-39(51)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h39-46,48,50-56H,3-38H2,1-2H3,(H,49,57)/t39-,40-,41-,42-,43-,44-,45+,46-,48-/m1/s1

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InChIKey: BQWQQAFVQIAJGU-XRZFIDNKSA-N

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Reference

PubChem CID: 162923256

SuperNatural Ⅲ: SN0032989-01

NPASS: NPC287356

Properties Information

Molecule Weight: 846.2849999999995

TPSA: 192.66

MolLogP: 9.513900000000008

Number of H-Donors: 8

Number of H-Acceptors: 10

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information