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[(2R,3S,4S,5R,6R)-6-amino-3,4,5-tris[(2,2-dimethylpropanoyl)oxy]oxan-2-yl]methyl 2,2-dimethylpropanoate

[(2R,3S,4S,5R,6R)-6-amino-3,4,5-tris[(2,2-dimethylpropanoyl)oxy]oxan-2-yl]methyl 2,2-dimethylpropanoate

CAS: 108342-87-6

Formula: C26H45NO9

SMILES: CC(C)(C)C(=O)OC[C@H]1O[C@@H](N)[C@H](OC(=O)C(C)(C)C)[C@@H](OC(=O)C(C)(C)C)[C@H]1OC(=O)C(C)(C)C

IUPAC: [(2R,3S,4S,5R,6R)-6-amino-3,4,5-tris[(2,2-dimethylpropanoyl)oxy]oxan-2-yl]methyl 2,2-dimethylpropanoate

InChI: InChI=1S/C26H45NO9/c1-23(2,3)19(28)32-13-14-15(34-20(29)24(4,5)6)16(35-21(30)25(7,8)9)17(18(27)33-14)36-22(31)26(10,11)12/h14-18H,13,27H2,1-12H3/t14-,15+,16+,17-,18-/m1/s1

Composition: C (60.56%), H (8.80%), N (2.72%), O (27.92%)

Molar Mass: 515.644

Atom Count: 81

Heavy Atom Count: 36

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 5
Exact Mass 515.309432033
Formal Charge 0
FSP3 0.85
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey IPRZVEFFDTWBGV-DISONHOPSA-N
Lipinski's Rule of Five
Molar Refractivity 129
Topological Polar Surface Area 140.45
Polarizability 53.26
Ring Count 1
Rotatable Bond Count 13

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 108342-87-6 $76.92-$258.51$76.92$112.23$258.51
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