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Dulcoside A

CAT: 1410-M29134-01Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M29134-01Size:1 mL x 10 mM in DMSO
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Description
Dulcoside A is isolated from Stevia rebaudiana. Dulcoside A is a sweetener and has antioxidant activity.
CAS Number
64432-06-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
788.881
Molecular Formula
C38H60O17
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Dulcoside A

Dulcoside A is a diterpene glycoside.

CAS Number64432-06-0
PubChem CID72941582
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,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-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
Molecular FormulaC38H60O17
Molecular Weight788.9
XLogP-0.7
Topological Polar Surface Area275
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count17
Rotatable Bond Count9
Heavy Atom Count55
Formal Charge0
Complexity1430
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@@]34CC[C@H]5[C@@]6(CCC[C@@]([C@H]6CC[C@]5(C3)CC4=C)(C)C(=O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)CO)O)O)O)O)O
InChI
InChI=1S/C38H60O17/c1-16-12-37-10-6-20-35(3,8-5-9-36(20,4)34(49)54-32-29(48)26(45)23(42)18(13-39)51-32)21(37)7-11-38(16,15-37)55-33-30(27(46)24(43)19(14-40)52-33)53-31-28(47)25(44)22(41)17(2)50-31/h17-33,39-48H,1,5-15H2,2-4H3/t17-,18+,19+,20-,21-,22-,23+,24+,25+,26-,27-,28+,29+,30+,31-,32-,33-,35+,36+,37+,38-/m0/s1
InChIKey
CANAPGLEBDTCAF-NTIPNFSCSA-N
Chemical Structure
2D Structure
2D structure of Dulcoside A
CAS: 64432-06-0
CID: 72941582
Formula: C38H60O17
MW: 788.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight788.9
XLogP3-0.7
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count17
Rotatable Bond Count9
Exact Mass788.38305044
Monoisotopic Mass788.38305044
Topological Polar Surface Area275 Ų
Heavy Atom Count55
Formal Charge0
Complexity1430
Isotope Atom Count0
Defined Atom Stereocenter Count21
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
OD29299-01Dulcoside A
HY-N6992RDulcoside A (Standard)
BUP24010-01Dulcoside C
MBS578399Dulcoside B
TRC-D720519-5MGDulcoside A (13CD2)

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