- Preparative method for isosilybin isolation based on enzymatic kinetic resolution of silymarin mixtureBy Gazak, Radek et al, Process Biochemistry (Oxford, 2013, 48(1), 184-189
Cas no 1516881-22-3 ((2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one)
![(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one structure](https://ossimg.kuujia.com/scimg/1517000/1516881-22-3x500.png)
1516881-22-3 structure
Product Name:(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one
CAS No:1516881-22-3
MF:C27H24O11
MW:524.472868919373
CID:5616140
Update Time:2024-02-03
(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one Chemical and Physical Properties
Names and Identifiers
-
- (2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one
-
- Inchi： 1S/C27H24O11/c1-12(28)35-11-22-26(13-3-5-16(30)19(7-13)34-2)37-18-6-4-14(8-20(18)36-22)27-25(33)24(32)23-17(31)9-15(29)10-21(23)38-27/h3-10,22,25-27,29-31,33H,11H2,1-2H3/t22-,25-,26-,27+/m0/s1
- InChI Key： NWQYNFZSVPVSTM-DQTXXJETSA-N
- SMILES： [C@H]1(C2=CC=C3O[C@@H](C4=CC=C(O)C(OC)=C4)[C@H](COC(C)=O)OC3=C2)OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
Experimental Properties
- Density: 1.477±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
- Boiling Point: 775.7±60.0 °C(Predicted)
- pka: 7.39±0.60(Predicted)
(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one Production Method
Production Method 1
Reaction Conditions
1.1C:1435939-45-9, S:Me2CO, 24 h, 45°C
Reference
(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one Raw materials
(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one Preparation Products
- Taxifolin (480-18-2)
- Silychristin (33889-69-9)
- Silybin A (22888-70-6)
- Isosilybin B (142796-22-3)
- 23-O-acetylsilybin A (1220986-69-5)
- Silydianin (29782-68-1)
- (2R,3R)-2-[(2R,3R)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one (1516881-20-1)
- (2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one (1516881-22-3)
- Isosilybin A (142796-21-2)
- Silybin B (142797-34-0)
(2R,3R)-2-[(2S,3S)-3-[(Acetyloxy)methyl]-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one Related Literature
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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