1.0 2016-05-22 05:32:30 UTC 2026-08-22 14:45:17 UTC Crocin SmallMolecule Crocin (C44H64O24) is a chemical compound used industrially as a dye and as an antioxidant for both biological and industrial applications (PMC13312991). Crocin belongs to the diterpenoids, a subclass of prenol lipids within the organic compounds. With an average molecular weight of 976.97 g/mol, Crocin is a heavy molecule. This compound is found in or released from 14 recorded sources across multiple sectors. In the healthcare, pharmaceuticals, and veterinary products sector, it is associated with medical devices. Within the energy, oil, and gas sector, as well as industrial manufacturing and chemical processing, it is found in lubricants. It is present in textiles, leather, and furnishings, specifically in synthetic textiles, carpets, and rugs. In the food, food processing, and cookware sector, it is linked to food packaging and the preparation of wine or sparkling wine. Furthermore, it is found in electrical and electronic equipment, including batteries, capacitors, cell phones, printed circuit boards, wires, cables, and one additional source. It is also found in one other sector. Recorded routes of exposure for crocin include touch, oral, and inhalation. PFAS Phytotoxin alpha-Crocin C44H64O24 976.972 976.378752941 bis[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl] (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate saffron 42553-65-1 C\C(\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)=C/C=C/C=C(\C)/C=C/C=C(\C)C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C44H64O24/c1-19(11-7-13-21(3)39(59)67-43-37(57)33(53)29(49)25(65-43)17-61-41-35(55)31(51)27(47)23(15-45)63-41)9-5-6-10-20(2)12-8-14-22(4)40(60)68-44-38(58)34(54)30(50)26(66-44)18-62-42-36(56)32(52)28(48)24(16-46)64-42/h5-14,23-38,41-58H,15-18H2,1-4H3/b6-5+,11-7+,12-8+,19-9+,20-10+,21-13+,22-14+/t23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33+,34+,35-,36-,37-,38-,41-,42-,43+,44+/m1/s1 SEBIKDIMAPSUBY-RTJKDTQDSA-N Organic compounds Lipids and lipid-like molecules Prenol lipids Diterpenoids Diterpenoids Acetals Carbonyl compounds Dicarboxylic acids and derivatives Disaccharides Enoate esters Fatty acid esters Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Acetal Alcohol Aliphatic heteromonocyclic compound Alpha,beta-unsaturated carboxylic ester Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dicarboxylic acid or derivatives Disaccharide Diterpenoid Enoate ester Fatty acid ester Fatty acyl Glycosyl compound Hydrocarbon derivative O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Aliphatic heteromonocyclic compounds diester disaccharide derivative diterpenoid Detected and Not Quantified logp -3.2 logp -0.02 ALOGPS logs -3.24 ALOGPS solubility 5.67e-01 g/l ALOGPS logp -3.2 ChemAxon pka_strongest_acidic 11.67 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac bis[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl] (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate ChemAxon average_mass 976.972 ChemAxon mono_mass 976.378752941 ChemAxon smiles C\C(\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)=C/C=C/C=C(\C)/C=C/C=C(\C)C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O ChemAxon formula C44H64O24 ChemAxon inchi InChI=1S/C44H64O24/c1-19(11-7-13-21(3)39(59)67-43-37(57)33(53)29(49)25(65-43)17-61-41-35(55)31(51)27(47)23(15-45)63-41)9-5-6-10-20(2)12-8-14-22(4)40(60)68-44-38(58)34(54)30(50)26(66-44)18-62-42-36(56)32(52)28(48)24(16-46)64-42/h5-14,23-38,41-58H,15-18H2,1-4H3/b6-5+,11-7+,12-8+,19-9+,20-10+,21-13+,22-14+/t23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33+,34+,35-,36-,37-,38-,41-,42-,43+,44+/m1/s1 ChemAxon inchikey SEBIKDIMAPSUBY-RTJKDTQDSA-N ChemAxon polar_surface_area 391.2 ChemAxon refractivity 233.49 ChemAxon polarizability 100.07 ChemAxon rotatable_bond_count 20 ChemAxon acceptor_count 22 ChemAxon donor_count 14 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bbfe2d900> DB11874 5281233 4444645