[(2R,3S,4S,5R,6S)-6-{4-[(8aS)-7-methyl-1,2,3,5,8,8a-hexahydroindolizin-6-yl]phenoxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate
AlkaPlorer ID: AK318462
Synonym: None
IUPAC Name: [(2R,3S,4S,5R,6S)-6-[4-[(8aS)-7-methyl-1,2,3,5,8,8a-hexahydroindolizin-6-yl]phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate
Structure
SMILES: COC1=CC(/C=C/C(=O)OC[C@H]2O[C@@H](OC3=CC=C(C4=C(C)C[C@@H]5CCCN5C4)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)=CC(OC)=C1O
InChI: InChI=1S/C32H39NO10/c1-18-13-21-5-4-12-33(21)16-23(18)20-7-9-22(10-8-20)42-32-31(38)30(37)29(36)26(43-32)17-41-27(34)11-6-19-14-24(39-2)28(35)25(15-19)40-3/h6-11,14-15,21,26,29-32,35-38H,4-5,12-13,16-17H2,1-3H3/b11-6+/t21-,26+,29+,30-,31+,32+/m0/s1
InChIKey: ORINCJLXWYDTJY-PFYFFWQGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ipomoea alba | Ipomoea | Convolvulaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 597.6610000000004
TPSA？: 147.38000000000002
MolLogP？: 2.494000000000001
Number of H-Donors: 4
Number of H-Acceptors: 11
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|