Actein

CAT: 1410-M23848-03Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1410-M23848-03Size:10 mg

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Description

Actein has a stimulatory effect on osteoblastic bone formation or has potential activity against osteoporosis, it also can prevent oxidative damage to osteoblasts in osteoporotic patients.

CAS Number

18642-44-9

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

676.9

Molecular Formula

C37H56O11

Notes

Research use only, not for human use.

Receptor

Akt|Apoptosis|JNK

Chemical Information

Actein

Actein is a triterpenoid. It has a role as a metabolite.

CAS Number	18642-44-9
PubChem CID	10032468
IUPAC Name	[(1S,1'R,2S,3'R,4R,4'R,5R,5'R,6'R,10'S,12'S,13'S,16'R,18'S,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate
Molecular Formula	C37H56O11
Molecular Weight	676.8
XLogP	3.3
Topological Polar Surface Area	157
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	4
Heavy Atom Count	48
Formal Charge	0
Complexity	1390

SMILES

C[C@@H]1C[C@@]2([C@H]3[C@](O3)([C@H](O2)O)C)O[C@@H]4[C@H]1[C@]5([C@@H](C[C@@]67C[C@@]68CC[C@@H](C([C@@H]8CC[C@H]7[C@@]5(C4)C)(C)C)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O)O)OC(=O)C)C

InChI

InChI=1S/C37H56O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h17,19-30,39-42H,8-16H2,1-7H3/t17-,19-,20+,21+,22+,23+,24-,25+,26+,27-,28+,29-,30+,32+,33-,34+,35-,36+,37-/m1/s1

InChIKey

NEWMWGLPJQHSSQ-PSDKAYTQSA-N

Chemical Structure

2D Structure

CAS: 18642-44-9

CID: 10032468

Formula: C37H56O11

MW: 676.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	676.8
XLogP3	3.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	4
Exact Mass	676.38226260
Monoisotopic Mass	676.38226260
Topological Polar Surface Area	157 Å²
Heavy Atom Count	48
Formal Charge	0
Complexity	1390
Isotope Atom Count	0
Defined Atom Stereocenter Count	19
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
HY-N6872-01	Actein
HY-N6872R	Actein (Standard)

Actein

Chemical Information

Alternative Products

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