Acrovestone

CAT: 0926-ZAA17716-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-ZAA17716-02Size:25 mg

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CAS Number

24177-16-0

Smiles

CC (C) CC (C1=C (C (=C (C (=C1O) CC=C (C) C) O) C (=O) C) O) C2=C (C (=C (C (=C2O) CC=C (C) C) OC) C (=O) C) O

Molecular Formula

C32H42O8

Molecular Weight

554.7 g/mol

Controlled

Chemical Information

1-(3-(1-(3-Acetyl-2,6-dihydroxy-4-methoxy-5-(3-methyl-2-buten-1-yl)phenyl)-3-methylbutyl)-2,4,6-trihydroxy-5-(3-methyl-2-buten-1-yl)phenyl)ethanone

Acrovestone is a polyphenol that is isolated from Acronychia pedunculata and exhibits moderate antioxidant and antityrosinase activities. It has a role as an antioxidant, an EC 1.14.18.1 (tyrosinase) inhibitor and a plant metabolite. It is a member of acetophenones, a polyphenol, an aromatic ether and an olefinic compound.

CAS Number	24177-16-0
PubChem CID	159969
IUPAC Name	1-[3-[1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-methylbutyl]-2,4,6-trihydroxy-5-(3-methylbut-2-enyl)phenyl]ethanone
Molecular Formula	C32H42O8
Molecular Weight	554.7
XLogP	8
Topological Polar Surface Area	145
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	11
Heavy Atom Count	40
Formal Charge	0
Complexity	918

SMILES

CC(C)CC(C1=C(C(=C(C(=C1O)CC=C(C)C)O)C(=O)C)O)C2=C(C(=C(C(=C2O)CC=C(C)C)OC)C(=O)C)O

InChI

InChI=1S/C32H42O8/c1-15(2)10-12-20-27(35)23(18(7)33)30(38)25(28(20)36)22(14-17(5)6)26-29(37)21(13-11-16(3)4)32(40-9)24(19(8)34)31(26)39/h10-11,17,22,35-39H,12-14H2,1-9H3

InChIKey

KLFWXYAHGSXKAW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 24177-16-0

CID: 159969

Formula: C32H42O8

MW: 554.7

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	554.7
XLogP3	8
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	11
Exact Mass	554.28796829
Monoisotopic Mass	554.28796829
Topological Polar Surface Area	145 Å²
Heavy Atom Count	40
Formal Charge	0
Complexity	918
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
TSP-21212019-01	Acrovestone

Acrovestone

Chemical Information

Alternative Products

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