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N-(1-{[5-({5-[(4-{[3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl)hexadecanamide

N-(1-{[5-({5-[(4-{[3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl)hexadecanamide

Formula: C66H120N2O28

SMILES: CCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4NC(C)=O)C3O)C(O)C2O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC

IUPAC: N-(1-{[5-({5-[(4-{[3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl)hexadecanamide

InChI: InChI=1/C66H120N2O28/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-40(75)39(68-46(76)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2)37-87-63-55(84)52(81)58(44(35-72)91-63)93-65-56(85)53(82)59(45(36-73)92-65)94-66-57(86)61(50(79)43(34-71)90-66)96-62-47(67-38(3)74)60

Composition: C (57.04%), H (8.70%), N (2.02%), O (32.24%)

Molar Mass: 1389.672

Atom Count: 216

Heavy Atom Count: 96

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 27
Exact Mass 1388.802761232
Formal Charge 0
FSP3 0.94
Hetero Ring Count 5
Hydrogen Bond Acceptor Count 28
Hydrogen Bond Donor Count 18
InChIKey JQLMIJWOLVZGEV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 338.94
Topological Polar Surface Area 474.18
Polarizability 138.18
Ring Count 5
Rotatable Bond Count 46

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Purity (%)
-
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Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <14 Days C66H120N2O28 Quote Only