sennoside
group of stereoisomers
Press Enter · cited answer in seconds
0 sources
sennoside
Summary
sennoside is a group of stereoisomers[1].
Key Facts
- sennoside's instance of is recorded as group of stereoisomers[2].
- sennoside's EC number is recorded as 208-238-9[3].
- sennoside's canonical SMILES is recorded as C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O[4].
- sennoside's InChI is recorded as InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58)/t23-,24-,25?,26?,31-,32-,35+,36+,37-,38-,41-,42-/m1/s1[5].
- sennoside's InChIKey is recorded as IPQVTOJGNYVQEO-JLDSCGAUSA-N[6].
- sennoside's chemical formula is recorded as C₄₂H₃₈O₂₀[7].
- sennoside's subclass of is recorded as 9-[2-carboxy-4-hydroxy-10-oxo-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid[8].
- sennoside's UNII is recorded as 9VK7V8762D[9].
- sennoside's ChemSpider ID is recorded as 571107[10].
- sennoside's PubChem CID is recorded as 656822[11].
- sennoside's KEGG ID is recorded as C13940[12].
- sennoside's KEGG ID is recorded as D02171[13].
- sennoside's ChEBI ID is recorded as 34974[14].
- sennoside's isomeric SMILES is recorded as C1=CC2=C(C(=C1)O[C@H]3C@@HO)C(=O)C4=C(C2C5C6=C(C(=CC=C6)O[C@H]7C@@HO)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)OC@@HO)C(=O)C4=C(C2C5C6=C(C(=CC=C6)O[C@H]7C@@HO)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C">[15].
- sennoside's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+862.196'}[16].
- sennoside's ECHA Substance Infocard ID is recorded as 100.007.491[17].
- sennoside's SureChEMBL ID is recorded as 11140501[18].
- sennoside's UniChem compound ID is recorded as 558959[19].