CAS No. 63550-99-2

 

Product Information

Chemical Formula: C44H70O22
Molecular Weight:951.01
Synonyms:(4α)-13-[(O-6-Deoxy-α-L-Mannopyranosyl-(1→2)-O-[β-D-Glucopyranosyl-(1→3)]-β-D-Glucopyranosyl)Oxy]Kaur-16-En-18-Oic Acid β-D-Glucopyranosyl Ester; Rebaudiosidec; (4R)-13-[[2-O-(6-Deoxy-α-L-Mannopyranosyl)-3-O-(β-D-Glucopyranosyl)-β-D-Glucopyranosyl]Oxy]Kaur-16-En-18-Oic Acid β-D-Glucopyranosyl Ester; (4Alpha)-13-[(O-6-Deoxy-Alpha-L-Mannopyranosyl-(1-2)-O-[Beta-D-Glucopyranosyl-(1-3)]-Beta-D-Glucopyranosyl)Oxy]Kaur-16-En-18-Oic Acid Beta-D-Glucopyranosyl Ester; Rebaudioside C
MDL No.:MFCD02752304
EINECS / EC No.:N/A
Pubchem CID:60208888
IUPAC Name:[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,4S,5R,9S,10R,13S)-13-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
Standard InchI:InChI=1S/C44H70O22/c1-17-12-43-10-6-22-41(3,8-5-9-42(22,4)40(58)65-38-33(57)30(54)26(50)20(14-46)61-38)23(43)7-11-44(17,16-43)66-39-35(64-36-31(55)28(52)24(48)18(2)59-36)34(27(51)21(15-47)62-39)63-37-32(56)29(53)25(49)19(13-45)60-37/h18-39,45-57H,1,5-16H2,2-4H3/t18-,19+,20+,21+,22-,23-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33+,34-,35+,36-,37-,38-,39-,41+,42+,43+,44-/m0/s1
InchI Key:QSRAJVGDWKFOGU-WBXIDTKBSA-N
SMILES:CC1C(C(C(C(O1)OC2C(C(C(OC2OC34CCC5C6(CCCC(C6CCC5(C3)CC4=C)(C)C(=O)OC7C(C(C(C(O7)CO)O)O)O)C)CO)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O
Appearance:-
Melting Point:N/A
Boiling Point:1070 °Cat760mmHg
Density (Theoretical):1.55 g/cm3

Safety Information

Signal Word: Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338
Flash Point:310.4 °C
Transportation Information:N/A
GHS Pictograms:Exclamation Mark - GHS07