Arjunglucoside II

CAT: 0931-TN3448Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0931-TN3448Size:5 mg

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CAS Number

62369-72-6

Target

Others

Related Pathways

Others

Bioactivity

Arjunglucoside II exhibits a moderate free radical scavenging activity.

Smiles

CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)C2C1)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

Molecular Formula

C36H58O10

Molecular Weight

650.84

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Arjunglucoside II

2alpha,3beta,23-trihydroxyolean-12-en-28-oic acid 28-O-beta-D-glucopynoside is a triterpenoid saponin that is the carboxylic ester obtained by the formal condensation of the carboxy group of arjunolic acid with beta-D-glucopyranose. It has been isolated from Juglans sinensis. It has a role as a plant metabolite. It is a beta-D-glucoside, a pentacyclic triterpenoid, a carboxylic ester, a triterpenoid saponin and a monosaccharide derivative. It is functionally related to an arjunolic acid. It derives from a hydride of an oleanane.

CAS Number	62369-72-6
PubChem CID	52951052
IUPAC Name	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
Molecular Formula	C36H58O10
Molecular Weight	650.8
XLogP	4
Topological Polar Surface Area	177
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	5
Heavy Atom Count	46
Formal Charge	0
Complexity	1240

SMILES

C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)(C[C@H]([C@@H]([C@@]3(C)CO)O)O)C

InChI

InChI=1S/C36H58O10/c1-31(2)11-13-36(30(44)46-29-27(42)26(41)25(40)22(17-37)45-29)14-12-34(5)19(20(36)15-31)7-8-24-32(3)16-21(39)28(43)33(4,18-38)23(32)9-10-35(24,34)6/h7,20-29,37-43H,8-18H2,1-6H3/t20-,21+,22+,23+,24+,25+,26-,27+,28-,29-,32-,33-,34+,35+,36-/m0/s1

InChIKey

CJHYKSSBQRABTM-XJWBRSAFSA-N

Chemical Structure

2D Structure

CAS: 62369-72-6

CID: 52951052

Formula: C36H58O10

MW: 650.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	650.8
XLogP3	4
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	5
Exact Mass	650.40299804
Monoisotopic Mass	650.40299804
Topological Polar Surface Area	177 Å²
Heavy Atom Count	46
Formal Charge	0
Complexity	1240
Isotope Atom Count	0
Defined Atom Stereocenter Count	15
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
M31558-01	Arjunglucoside II
TBW00446	Arjunglucoside I

Arjunglucoside II

Chemical Information

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