| 2D Structure | |
| CID | 130796 |
| IUPAC Name | (4R)-2,6,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexene-1-carbaldehyde |
| InChI | InChI=1S/C16H26O7/c1-8-4-9(5-16(2,3)10(8)6-17)22-15-14(21)13(20)12(19)11(7-18)23-15/h6,9,11-15,18-21H,4-5,7H2,1-3H3/t9-,11-,12-,13+,14-,15-/m1/s1 |
| InChI Key | WMHJCSAICLADIN-WYWSWGBSSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C16H26O7 |
| Molecular Weight | 330.37 |
| synonyms | ['Picrocrocin', '138-55-6', '1-Cyclohexene-1-carboxaldehyde, 4-(beta-D-glucopyranosyloxy)-2,6,6-trimethyl-, (4R)-', 'ON5B022511', '(R)-4-(beta-D-Glucopyranosyloxy)-2,6,6-trimethyl-1-cyclohexene-1-carboxaldehyde', 'CHEBI:53168', 'DTXSID40160450', '(1R)-4-formyl-3,5,5-trimethylcyclohex-3-en-1-yl beta-D-glucopyranoside', '(4R)-2,6,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexene-1-carbaldehyde', '(4R)-2,6,6-trimethyl-4-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxycyclohexene-1-carbaldehyde', 'DTXCID0082941', 'Picrocrocine', 'saffron-bitter', '(R)-2,6,6-trimethyl-4-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)cyclohex-1-ene-1-carbaldehyde', 'Saffronbitter', 'Safranbitter', 'UNII-ON5B022511', 'Picrocrocin (Standard)', 'PICROCROCIN [MI]', 'SCHEMBL22180', 'orb1297245', 'HY-N4114R', 'WMHJCSAICLADIN-WYWSWGBSSA-N', 'HY-N4114', 'MSK15440', 'AKOS027326831', '1ST15440', 'AC-34396', 'AS-79122', 'MP156887', 'CS-0032123', 'NS00094694', 'C17055', 'E80643', 'Q289866', '(4R)-4-(.BETA.-D-GLUCOPYRANOSYLOXY)-2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-CARBOXALDEHYDE', '(4R)-4-(b-D-Glucopyranosyloxy)-2,6,6-trimethyl-1-cyclohexene-1-carboxaldehyde', '1-Cyclohexene-1-carboxaldehyde, 4-(|A-D-glucopyranosyloxy)-2,6,6-trimethyl-, (4R)-', '1-Cyclohexene-1-carboxaldehyde, 4-(beta-D-glucopyranosyloxy)-2,6,6-trimethyl-, (R)-', '1-Cyclohexene-1-carboxaldehyde, 4-(ss-D-glucopyranosyloxy)-2,6,6-trimethyl-, (4R)-', '(4R)-2,6,6-Trimethyl-4-[(2R,4S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexene-1-carbaldehyde'] |
From Pubchem