Crocin 2
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Crocin 2
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CAS No:
55750-84-0
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Formula:
C38H54O19
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Chemical Name:
Crocin 2
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Synonyms:
β-D-Glucopyranose,6-O-β-D-glucopyranosyl-,1-[β-D-glucopyranosyl (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethyl-2,4,6,8,10,12,14-hexadecaheptaenedioate];8,8′-Diapo-ψ,ψ-carotenedioic acid,β-D-glucopyranosyl 6-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester;Crocin 2;all-trans-Crocetin β-D-gentiobiosyl-β-D-glucosyl ester;Crocetin gentiobiosylglucosyl ester;Crocin 3;Tricrocin;Crocin B;trans-Crocetin (β-D-glucosyl)-(β-D-gentiobiosyl) ester;Crocin II;trans-Crocin 2;trans-Crocetin (β-D-gentiobiosyl) (β-D-glucosyl) ester;Trans-crocin-2;trans-3-Gg-crocin;Trans-Crocin 3;1160167-04-3;2082718-29-2
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CAS No:
Description
Crocin II is isolated from the fruit of Gardenia jasminoides with antioxidant, anticancer, and antidepressant activity.Crocin II inhibits NO production with an IC50 value of 31.1 μM.Crocin II suppresses the expressions of protein and m-RNA of iNOS and COX-2[1].
Beta-D-gentiobiosyl beta-D-glucosyl crocetin is a diester resulting from the formal condensation of the carboxylic acid group of beta-D-gentiobiosyl crocetin with the anomeric hydroxy group of beta-D-glucopyranose. It is a beta-D-glucoside and a diester.
Computed Properties
Molecular Weight:814.8
XLogP3:-0.3
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:17
Exact Mass:814.32592949
Monoisotopic Mass:814.32592949
Topological Polar Surface Area:312
Heavy Atom Count:57
Complexity:1550
Defined Atom Stereocenter Count:15
Defined Bond Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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