(2R,3R,4R,5R,6S)-2-{3-[3-({4-[(2S)-2,3-dihydroxypropyl]-2,6-dimethoxyphenyl}amino)-2-hydroxy-4-methoxyphenyl]propoxy}-6-methyloxane-3,4,5-triol
AlkaPlorer ID: AK250126
Synonym: None
IUPAC Name: (2R,3R,4R,5R,6S)-2-[3-[3-[4-[(2S)-2,3-dihydroxypropyl]-2,6-dimethoxyanilino]-2-hydroxy-4-methoxyphenyl]propoxy]-6-methyloxane-3,4,5-triol
Structure
SMILES: COC1=C(NC2=C(O)C(CCCO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)=CC=C2OC)C(OC)=CC(C[C@H](O)CO)=C1
InChI: InChI=1S/C27H39NO11/c1-14-23(31)25(33)26(34)27(39-14)38-9-5-6-16-7-8-18(35-2)22(24(16)32)28-21-19(36-3)11-15(10-17(30)13-29)12-20(21)37-4/h7-8,11-12,14,17,23,25-34H,5-6,9-10,13H2,1-4H3/t14-,17-,23-,25+,26+,27+/m0/s1
InChIKey: XGBWRXIJOYLKPR-VOWRPLDRSA-N
Reference
Three diterpene glucosides and a diphenylamine derivative from Pieris formosa
PubChem CID: 163014373
LOTUS: LTS0023164
SuperNatural Ⅲ: SN0429250-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pieris formosa | Pieris | Ericaceae | Ericales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 553.6050000000002
TPSA？: 179.55999999999997
MolLogP？: 0.8339999999999996
Number of H-Donors: 7
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|