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Rc

CAT: 1299-RM-G091405-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-G091405-03Size:25 mg
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CAS Number
11021-14-0
Synonyms
(2R,3S,4S,5R,6S) -2- ((((2R,3R,4R,5S) -3,4-dihydroxy-5- (hydroxymethyl) tetrahydrofuran-2-yl) oxy) methyl) -6- (((S) -2- ((3S,5R,8R,9R,10R,12R,13R,14R,17S) -3- (((2R,3R,4S,5S,6R) -4,5-dihydroxy-6- (hydroxymethyl) -3- (((2S,3R,4S,5S,6R) -3,4,5-trihydroxy-6- (hydroxymethyl) tetrahydro-2H-pyran-2-yl) oxy) tetrahydro-2H-pyran-2-yl) oxy) -12-hydroxy-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl) -6-methylhept-5-en-2-yl) oxy) tetrahydro-2H-pyran-3,4,5-triol
Molecular Formula
C53H90O22
Molecular Weight
1079.28
Target Alternative Name
Ginsenoside

Chemical Information

Ginsenoside Rc

Ginsenoside Rc is a ginsenoside found in Panax ginseng that is dammarane which is substituted by hydroxy groups at the 3beta, 12beta and 20 pro-S positions, in which the hydroxy groups at positions 3 and 20 have been converted to the corresponding beta-D-glucopyranosyl-(12)-beta-D-glucopyranoside and alpha-L-arabinofuranosyl-(16)-beta-D-glucopyranoside respectively, and in which a double bond has been introduced at the 24-25 position. It has a role as a hypoglycemic agent and a plant metabolite. It is a beta-D-glucoside, a tetracyclic triterpenoid, a 12beta-hydroxy steroid, a disaccharide derivative and a ginsenoside. It derives from a hydride of a dammarane.

CAS Number11021-14-0
PubChem CID12855889
IUPAC Name(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-17-[(2S)-2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC53H90O22
Molecular Weight1079.3
XLogP0.9
Topological Polar Surface Area357
Hydrogen Bond Donor Count14
Hydrogen Bond Acceptor Count22
Rotatable Bond Count16
Heavy Atom Count75
Formal Charge0
Complexity1950
SMILES
CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)O)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H](O8)CO)O)O)O)O)O)C
InChI
InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28-,29+,30-,31+,32-,33-,34+,35+,36-,37+,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-,50-,51+,52+,53-/m0/s1
InChIKey
JDCPEKQWFDWQLI-LUQKBWBOSA-N
Chemical Structure
2D Structure
2D structure of Ginsenoside Rc
CAS: 11021-14-0
CID: 12855889
Formula: C53H90O22
MW: 1079.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight1079.3
XLogP30.9
Hydrogen Bond Donor Count14
Hydrogen Bond Acceptor Count22
Rotatable Bond Count16
Exact Mass1078.59237449
Monoisotopic Mass1078.59237449
Topological Polar Surface Area357 Ų
Heavy Atom Count75
Formal Charge0
Complexity1950
Isotope Atom Count0
Defined Atom Stereocenter Count29
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes