| 2D Structure | |
| CID | 161036 |
| IUPAC Name | (3S,4R,4aS)-4-ethenyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one |
| InChI | InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1 |
| InChI Key | VSJGJMKGNMDJCI-ZASXJUAOSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C16H22O9 |
| Molecular Weight | 358.34 |
| synonyms | ['Sweroside', '14215-86-2', '(-)-Sweroside', 'I3YG76417O', '(3S,4R,4aS)-4-ethenyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one', 'DTXSID70161955', '1H,3H-Pyrano(3,4-c)pyran-1-one, 5-ethenyl-6-(beta-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-, (4aS-(4aalpha,5beta,6alpha))-', '1,9-trans-9,5-cis-sweroside', '(3S,4R,4aS)-4-ethenyl-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-4,4a,5,6-tetrahydro-3H-pyrano(3,4-c)pyran-8-one', 'DTXCID4084446', 'MFCD09954487', 'CHEBI:80907', 'UNII-I3YG76417O', '1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-6-(ss-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-, (4aS,5R,6S)-; 1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-6-(ss-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-, [4aS-(4aa,5ss,6a)]-; Sweroside (8CI); (-)-Sweroside; (4aS,5R,6S)-5-Ethenyl-6-(ss-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one', 'Sweroside (Standard)', 'SCHEMBL307117', 'CHEMBL456137', 'MEGxp0_000813', 'orb1300159', 'ACon0_001457', 'ACon1_000233', 'HY-N0806R', 'VSJGJMKGNMDJCI-ZASXJUAOSA-N', '1H,3H-PYRANO(3,4-C)PYRAN-1-ONE, 5-ETHENYL-6-(.BETA.-D-GLUCOPYRANOSYLOXY)-4,4A,5,6-TETRAHYDRO-, (4AS-(4A.ALPHA.,5.BETA.,6.ALPHA.))-', 'HY-N0806', 'BDBM50279544', 's9072', 'AKOS015960475', 'Sweroside, >=95% (LC/MS-ELSD)', 'CCG-268134', 'FS73846', 'NCGC00180755-01', 'NCGC00180755-03', 'AC-11215', 'AC-35080', 'AS-56077', 'DA-58207', 'CS-0009811', 'NS00094766', 'W0022', 'C17071', 'BRD-K31299876-001-01-5', 'Q27151406', '(3S,4R,4aS)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4-vinyl-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one', '1H,3H-PYRANO(3,4-C)PYRAN-1-ONE, 5-ETHENYL-6-(.BETA.-D-GLUCOPYRANOSYLOXY)-4,4A,5,6-TETRAHYDRO-, (4AS,5R,6S)-', 'InChI=1/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1'] |
From Pubchem