3,4-dihydroxy-5-(2-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-3-[(1H-indol-3-yl)methyl]oxolan-2-one
AlkaPlorer ID: AK264416
Synonym: None
IUPAC Name: 3,4-dihydroxy-5-[2-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3-(1H-indol-3-ylmethyl)oxolan-2-one
Structure
SMILES: O=C1OC(C(CO)OC2OC(CO)C(O)C(O)C2O)C(O)C1(O)CC1=CNC2=CC=CC=C12
InChI: InChI=1S/C21H27NO11/c23-7-12-14(25)15(26)16(27)19(31-12)32-13(8-24)17-18(28)21(30,20(29)33-17)5-9-6-22-11-4-2-1-3-10(9)11/h1-4,6,12-19,22-28,30H,5,7-8H2
InChIKey: VYKGRASPXUUIKX-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cardamine diphylla | Cardamine | Brassicaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 469.44300000000015
TPSA？: 202.16
MolLogP？: -3.0947999999999967
Number of H-Donors: 8
Number of H-Acceptors: 11
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|