[(2R,3R,4R)-3,4-bis(acetyloxy)-6-carbamoyl-3,4-dihydro-2H-pyran-2-yl]methyl acetate

[(2R,3R,4R)-3,4-bis(acetyloxy)-6-carbamoyl-3,4-dihydro-2H-pyran-2-yl]methyl acetate

CAS: 183233-11-6

Formula: C13H17NO8

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

IUPAC: [(2R,3R,4R)-3,4-bis(acetyloxy)-6-carbamoyl-3,4-dihydro-2H-pyran-2-yl]methyl acetate

InChI: InChI=1S/C13H17NO8/c1-6(15)19-5-11-12(21-8(3)17)9(20-7(2)16)4-10(22-11)13(14)18/h4,9,11-12H,5H2,1-3H3,(H2,14,18)/t9-,11-,12+/m1/s1

Composition: C (49.53%), H (5.44%), N (4.44%), O (40.60%)

Molar Mass: 315.278

Atom Count: 39

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	315.095416511
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XUVLXMVOLKHALG-YUSALJHKSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.36
Topological Polar Surface Area	131.22
Polarizability	28.2
Ring Count	1
Rotatable Bond Count	8

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