SILYBIN

CAS No.
36804-17-8 ;65666-07-1 ;802918-57-6 ;22888-70-6 ;72581-71-6
CCD No.
CCD00178472
Formula
C25 H22 O10
MolWeight
482.439

Basic Information

Product Name: SILYBIN
CAS: 36804-17-8 ;65666-07-1 ;802918-57-6 ;22888-70-6 ;72581-71-6
English Synonyms: FLAVOBIN ; 2-[2R,3R-DIHYDRO-3-(4-HYDROXY-3-METHOXYPHENYL)-2-(HYDROXYMETHYL)-1,4-BENZODIOXIN-6-YL]-2R,3R-DIHYDRO-3,5,7-TRIHYDROXY-4H-1-BENZOPYRAN-4-ONE ; SILYBIN A ; PRINCIPAL COMPONENT OF SILYMARINE ; 2,3-DIHYDRO-3-(4-HYDROXY-3-METHOXYPHENYL)-2-(HYDROXYMETHYL)-6-(3,5,7-TRIHYDROXY-4-OXOBENZOPYRAN-2-YL)BENZODIOXIN ; SILLIVER ; SILYBIN (A AND B) ; (2R,3R)-3,5,7-TRIHYDROXY-2-((2R,3R)-3-(4-HYDROXY-3-METHOXYPHENYL)-2-(HYDROXYMETHYL)-2,3-DIHYDROBENZO[B][1,4]DIOXIN-6-YL)CHROMAN-4-ONE ; SILYMARIN GROUP ; SILYMARIN I ; ISOSILYBIN ; SILYMARIN ; SILYBIN ; SILYBININ ; 4H-1-BENZOPYRAN-4-ONE, 2-[(2R,3R)-2,3-DIHYDRO-3-(4-HYDROXY-3-METHOXYPHENYL)-2-(HYDROXYMETHYL)-1,4-BENZODIOXIN-6-YL]-2,3-DIHYDRO-3,5,7-TRIHYDROXY-, (2R,3R)- ; (2R,3R)-3,5,7-TRIHYDROXY-2-[3-(4-HYDROXY-3-METHOXYPHENYL)-2-HYDROXYMETHYL-2,3-DIHYDROBENZO[1,4]DIOXIN-6-YL]CHROMAN-4-ONE ; DAB10 ; SILIBININ
MDL Number.: MFCD00872186
H bond acceptor: 10
H bond donor: 5
Smile: COc1cc(ccc1O)[C@@H]2[C@H](Oc3ccc(cc3O2)[C@@H]4[C@H](C(=O)c5c(cc(cc5O4)O)O)O)CO
InChi: InChI=1S/C25H22O10/c1-32-17-6-11(2-4-14(17)28)24-20(10-26)33-16-5-3-12(7-18(16)34-24)25-23(31)22(30)21-15(29)8-13(27)9-19(21)35-25/h2-9,20,23-29,31H,10H2,1H3/t20-,23+,24-,25-/m1/s1
InChiKey: InChIKey=SEBFKMXJBCUCAI-HKTJVKLFSA-N

Property

Comments: GENERAL DESCRIPTION: SILIBININ PRIMARY ISOMER
RTECS: DJ2981770
UNSPSC: 12352100
WGK: 3
Information: MIXTURE OF ISOMERS

Safety information

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