(1R,7aS)-hexahydro-1H-pyrrolizin-1-ylmethyl (2E)-3-(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate
AlkaPlorer ID: AK325062
Synonym: None
IUPAC Name: [(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate
Structure
SMILES: O=C(/C=C/C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1)OC[C@@H]1CCN2CCC[C@@H]12
InChI: InChI=1S/C23H31NO8/c25-12-18-20(27)21(28)22(29)23(32-18)31-16-6-3-14(4-7-16)5-8-19(26)30-13-15-9-11-24-10-1-2-17(15)24/h3-8,15,17-18,20-23,25,27-29H,1-2,9-13H2/b8-5+/t15-,17-,18+,20+,21-,22+,23+/m0/s1
InChIKey: VRWXOVDCMDXQDO-XSWPKGSUSA-N
Source
Properties Information
Molecule Weight: 449.50000000000034
TPSA？: 128.92000000000002
MolLogP？: -0.0940000000000003
Number of H-Donors: 4
Number of H-Acceptors: 9
RingCount: 4
Activities Information
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