[(2S,3R,4S,5R)-2,5-bis(4-hydroxy-3-methoxyphenyl)-4-{[2-(4-hydroxyphenyl)ethyl]carbamoyl}oxolan-3-yl]methyl acetate
AlkaPlorer ID: AK135819
Synonym: None
IUPAC Name: [(2S,3R,4S,5R)-2,5-bis(4-hydroxy-3-methoxyphenyl)-4-[2-(4-hydroxyphenyl)ethylcarbamoyl]oxolan-3-yl]methyl acetate
Structure
SMILES: COC1=CC([C@H]2O[C@@H](C3=CC=C(O)C(OC)=C3)[C@@H](C(O)=NCCC3=CC=C(O)C=C3)[C@@H]2COC(C)=O)=CC=C1O
InChI: InChI=1S/C30H33NO9/c1-17(32)39-16-22-27(30(36)31-13-12-18-4-8-21(33)9-5-18)29(20-7-11-24(35)26(15-20)38-3)40-28(22)19-6-10-23(34)25(14-19)37-2/h4-11,14-15,22,27-29,33-35H,12-13,16H2,1-3H3,(H,31,36)/t22-,27-,28+,29-/m0/s1
InChIKey: QJCJQOHFWDDBIP-OUEGXDDWSA-N
Reference
Jacpaniculines the first lignanamide alkaloids from the convolvulaceae
PubChem CID: 101678877
LOTUS: LTS0043928
SuperNatural Ⅲ: SN0306849-04
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Jacquemontia paniculata | Jacquemontia | Convolvulaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 551.5920000000004
TPSA？: 147.27
MolLogP？: 4.627900000000004
Number of H-Donors: 4
Number of H-Acceptors: 9
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|