24-Amino-2,16,20,25-tetrahydroxycucurbita-1,5-diene-3,11,22-trione; (16α,20R,24R)-form, 24,25-Carbamate, 2-O-β-D-glucopyranoside
AlkaPlorer ID: AK287559
Synonym: None
IUPAC Name: 17-[4-(5,5-dimethyl-2-oxo-1,3-oxazolidin-4-yl)-2-hydroxy-3-oxobutan-2-yl]-16-hydroxy-4,4,9,13,14-pentamethyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione
Structure
SMILES: CC1(C)C(=O)C(OC2OC(CO)C(O)C(O)C2O)=CC2C1=CCC1C2(C)C(=O)CC2(C)C(C(C)(O)C(=O)CC3NC(=O)OC3(C)C)C(O)CC12C
InChI: InChI=1S/C37H53NO13/c1-32(2)16-9-10-21-34(5)13-18(40)28(37(8,48)23(41)12-22-33(3,4)51-31(47)38-22)35(34,6)14-24(42)36(21,7)17(16)11-19(29(32)46)49-30-27(45)26(44)25(43)20(15-39)50-30/h9,11,17-18,20-22,25-28,30,39-40,43-45,48H,10,12-15H2,1-8H3,(H,38,47)
InChIKey: LSGLQIRVQKVXDL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Machilus | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 719.8250000000002
TPSA？: 229.38
MolLogP？: 0.8279000000000011
Number of H-Donors: 7
Number of H-Acceptors: 13
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|