10,22-dihydroxy-14-(hydroxymethyl)-7,18-dimethyl-19-(5-oxo-2,5-dihydrofuran-3-yl)-4,6,11-trioxaspiro[hexacyclo[12.11.0.0³,¹².0?,¹?.0¹?,²³.0¹?,²²]pentacosane-9,2'-[1,3]thiazolidin]-4'-one
AlkaPlorer ID: AK021845
Synonym: None
IUPAC Name: 10',22'-dihydroxy-14'-(hydroxymethyl)-7',18'-dimethyl-19'-(5-oxo-2H-furan-3-yl)spiro[1,3-thiazolidine-2,9'-4,6,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosane]-4-one
Structure
SMILES: CC1CC2(N=C(O)CS2)C2(O)OC3CC4(CO)C(CCC5C4CCC4(C)C(C6=CC(=O)OC6)CCC54O)CC3OC2O1
InChI: InChI=1S/C31H43NO9S/c1-16-11-30(32-24(34)14-42-30)31(37)26(39-16)40-22-10-18-3-4-21-20(28(18,15-33)12-23(22)41-31)5-7-27(2)19(6-8-29(21,27)36)17-9-25(35)38-13-17/h9,16,18-23,26,33,36-37H,3-8,10-15H2,1-2H3,(H,32,34)
InChIKey: GRINEMOQBRCRRY-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Calotropis procera | Calotropis | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 605.7500000000005
TPSA？: 147.27
MolLogP？: 2.8328000000000007
Number of H-Donors: 4
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|