Geniposidic acid; L-Phenylalanine amide
AlkaPlorer ID: AK299137
Synonym: Eucomoside B
IUPAC Name: 2-[[7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carbonyl]amino]-3-phenylpropanoic acid
Structure
SMILES: O=C(NC(CC1=CC=CC=C1)C(=O)O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(CO)=CCC12
InChI: InChI=1S/C25H31NO11/c27-9-13-6-7-14-15(22(32)26-16(23(33)34)8-12-4-2-1-3-5-12)11-35-24(18(13)14)37-25-21(31)20(30)19(29)17(10-28)36-25/h1-6,11,14,16-21,24-25,27-31H,7-10H2,(H,26,32)(H,33,34)
InChIKey: BJOGMUBKBDAOFW-UHFFFAOYSA-N
Reference
CAS: 951672-66-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Eucommia ulmoides | Eucommia | Eucommiaceae | Garryales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 521.5190000000002
TPSA？: 195.24
MolLogP？: -1.589999999999998
Number of H-Donors: 7
Number of H-Acceptors: 10
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|