(-) -Dihydroguaiaretic acid

CAT: 0926-ZEA64978-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-ZEA64978-01Size:25 mg

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CAS Number

124649-78-1

Smiles

C1=CC (=C2C (=C1) NC (=N2) N3C=CN=C3) N

Molecular Formula

C20H26O4

Molecular Weight

330.40 g/mol

Controlled

Chemical Information

(-)-Dihydroguaiaretic acid

(-)-dihydroguaiaretic acid has been reported in Saururus chinensis, Micranthemum umbrosum, and other organisms with data available.

CAS Number	124649-78-1
PubChem CID	11602375
IUPAC Name	4-[(2R,3R)-4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbutyl]-2-methoxyphenol
Molecular Formula	C20H26O4
Molecular Weight	330.4
XLogP	5
Topological Polar Surface Area	58.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Heavy Atom Count	24
Formal Charge	0
Complexity	328

SMILES

C[C@H](CC1=CC(=C(C=C1)O)OC)[C@H](C)CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C20H26O4/c1-13(9-15-5-7-17(21)19(11-15)23-3)14(2)10-16-6-8-18(22)20(12-16)24-4/h5-8,11-14,21-22H,9-10H2,1-4H3/t13-,14-/m1/s1

InChIKey

ADFOLUXMYYCTRR-ZIAGYGMSSA-N

Chemical Structure

2D Structure

CAS: 124649-78-1

CID: 11602375

Formula: C20H26O4

MW: 330.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	330.4
XLogP3	5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	330.18310931
Monoisotopic Mass	330.18310931
Topological Polar Surface Area	58.9 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	328
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FR11870-01	Ribonucleic acid free acid
G-3600-01	D-Glucuronic acid, free acid
HXC53910	Acid-PEG2-SS-PEG2-acid
HXC88802-01	(3R) -3-Aminodecanoic acid, trifluoroacetic acid
TSA90819-01	Glycosmisic acid
FK74528-01	Kaurenoic acid
FI37886	Isonicotinic acid
FI179943-01	Isodeoxycholic acid
YGA93275-01	Gambogenic acid
YEA13505-01	Uncaric acid

Catalog	Name
T28021	Dihydroguaiaretic acid
163835	(±) -Dihydroguaiaretic Acid
HY-N10898	(-) -Dihydroguaiaretic acid
TRC-D449715-25MG	(±)-Dihydroguaiaretic Acid
MBS5791608	(-)-Dihydroguaiaretic acid
TN1581	Meso-Dihydroguaiaretic acid
163836	(±) -Dihydroguaiaretic Acid-d6
TRC-D449717-50MG	(±)-Dihydroguaiaretic Acid-d6
HY-N6087R	Meso-Dihydroguaiaretic acid (Standard)
OR1071368-01	Acid-apeg6-acid