| 2D Structure | |
| CID | 101922021 |
| IUPAC Name | (1R,2R,4S,5R,8R,10S,13R,14R,18S,21S)-10-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20,20-heptamethyl-22-oxahexacyclo[19.2.1.01,18.04,17.05,14.08,13]tetracos-16-en-23-one |
| InChI | InChI=1S/C47H74O18/c1-42(2)14-21-20-8-9-26-44(5)12-11-28(43(3,4)25(44)10-13-45(26,6)46(20,7)15-27(50)47(21)16-29(42)64-41(47)58)63-40-37(65-39-36(57)33(54)31(52)23(17-48)61-39)34(55)32(53)24(62-40)19-60-38-35(56)30(51)22(49)18-59-38/h8,21-40,48-57H,9-19H2,1-7H3/t21-,22-,23+,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1 |
| InChI Key | IGUMKDPFGXLXSS-GUNIGVGBSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C47H74O18 |
| Molecular Weight | 927.1 |
| synonyms | ['Albiziasaponin B', 'RefChem:915361', '(1R,2R,4S,5R,8R,10S,13R,14R,18S,21S)-10-((2R,3R,4S,5S,6R)-4,5-dihydroxy-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-6-(((2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl)oxymethyl)oxan-2-yl)oxy-2-hydroxy-4,5,9,9,13,20,20-heptamethyl-22-oxahexacyclo(19.2.1.01,18.04,17.05,14.08,13)tetracos-16-en-23-one', '164178-25-0', 'SCHEMBL30834773'] |
From Pubchem