12-O-Methylcarnosic acid

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For Research Use Only.

Category

Diterpenoids

Cat.No.

NP1358

CAS

62201-71-2

Product Name

12-O-Methylcarnosic acid

Structure

Product Details

Description

12-O-Methylcarnosic acid is a natural diterpenoid compound found in several plants.

Synonyms

Carnosic acid 12-methyl ether;12-Methoxycarnosic acid

IUPAC Name

(4aR,10aS)-5-hydroxy-6-methoxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid

Molecular Weight

346.461

Molecular Formula

C21H30O4

Canonical SMILES

CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)OC

InChI

InChI=1S/C21H30O4/c1-12(2)14-11-13-7-8-15-20(3,4)9-6-10-21(15,19(23)24)16(13)17(22)18(14)25-5/h11-12,15,22H,6-10H2,1-5H3,(H,23,24)/t15-,21+/m0/s1

InChIKey

QQNSARJGBPMQDI-YCRPNKLZSA-N

Boiling Point

505.1±50.0 °C(Predicted)

Purity

>98%

Density

1.1±0.1 g/cm3

Appearance

Powder

Storage

-20°C

Form

Powder

Hazard Class

Xn,N

MDL

MFCD24849312

NACRES

NA.25

pKa

4.12±0.40(Predicted)

RIDADR

UN 3077 9 / PGIII

Risk Statements

22-50

Safety Statements

WGK Germany

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