Manool

Inquiry

For Research Use Only.

Category

Lignans

Cat.No.

NP3930

CAS

596-85-0

Product Name

Manool

Structure

Product Details

Description

Manool is a plant metabolite with antibacterial and antineoplastic activity.

Synonyms

(3R)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

IUPAC Name

(3R)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

Molecular Weight

290.48

Molecular Formula

C20H34O

Canonical SMILES

CC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)C

InChI

InChI=1S/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3/t16-,17-,19-,20+/m0/s1

InChIKey

CECREIRZLPLYDM-QGZVKYPTSA-N

Boiling Point

150-153 °C(Press: 0.3 Torr)

Melting Point

49-52 °C(lit.)

Flash Point

>230 °F

Purity

95%

Density

0.93±0.1 g/cm3(Predicted)

Definition

ChEBI: A labdane diterpenoid in which the labdane skeleton has double bonds at positions 8(17) and 14 and carries an R-hydroxy group at position 13.

Hazard Class

pKa

14.47±0.29(Predicted)

Risk Statements

36/37/38

Safety Statements

26-36

Uses

Maintains anti-proliferative activity against human malignant cell strains.

WGK Germany

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