Crocetin digentiobiosyl ester
group of stereoisomers with the chemical formula C₄₄H₆₄O₂₄
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Crocetin digentiobiosyl ester
Summary
Crocetin digentiobiosyl ester is a group of stereoisomers[1].
Key Facts
- Crocetin digentiobiosyl ester's instance of is recorded as group of stereoisomers[2].
- Crocetin digentiobiosyl ester's canonical SMILES is recorded as O=C(OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)C(=CC=CC(=CC=CC=C(C=CC=C(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C)C)C)C[3].
- Crocetin digentiobiosyl ester's InChI is recorded as 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[4].
- Crocetin digentiobiosyl ester's InChIKey is recorded as SEBIKDIMAPSUBY-IKPIERSTSA-N[5].
- Crocetin digentiobiosyl ester's chemical formula is recorded as C₄₄H₆₄O₂₄[6].
- Crocetin digentiobiosyl ester's subclass of is recorded as chemical compound[7].
- Crocetin digentiobiosyl ester's PubChem CID is recorded as 44630212[8].
- Crocetin digentiobiosyl ester's found in taxon is recorded as Crocus sativus[9].
- Crocetin digentiobiosyl ester's isomeric SMILES is recorded as CC(/C=C/C=C(\C)C(=O)OC1OC@HC@@HC@H[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)OC1OC@HC@@HC@H[C@H]1OC@HC@@HC@H[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)OC1O[C@H](CO[C">[10].
- Crocetin digentiobiosyl ester's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+976.378752928'}[11].
- Crocetin digentiobiosyl ester's UniChem compound ID is recorded as 24409168[12].