(2S,4aR,6S,7R,8R,8aS)-6-(benzyloxy)-7-acetamido-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-8-yl benzoate
AlkaPlorer ID: AK447827
Synonym: None
IUPAC Name: [(2S,4aR,6S,7R,8R,8aS)-7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] benzoate
Structure
SMILES: CC(=O)N[C@H]1[C@@H](OCC2=CC=CC=C2)O[C@@H]2CO[C@H](C3=CC=CC=C3)O[C@H]2[C@@H]1OC(=O)C1=CC=CC=C1
InChI: InChI=1S/C29H29NO7/c1-19(31)30-24-26(36-27(32)21-13-7-3-8-14-21)25-23(18-34-28(37-25)22-15-9-4-10-16-22)35-29(24)33-17-20-11-5-2-6-12-20/h2-16,23-26,28-29H,17-18H2,1H3,(H,30,31)/t23-,24-,25-,26-,28+,29+/m1/s1
InChIKey: LQJFJWAUQYLCIP-SYHBSSCQSA-N
Source
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Properties Information
Molecule Weight: 503.5510000000002
TPSA？: 92.32000000000002
MolLogP？: 3.7726000000000015
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 5
Activities Information
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