(16R)-18,19-Didehydro-17-hydroxycorynan-16-carboxylic acid methyl ester

Inquiry

For Research Use Only.

Category

Alkaloids

Cat.No.

NP0124

CAS

1245-00-7

Product Name

(16R)-18,19-Didehydro-17-hydroxycorynan-16-carboxylic acid methyl ester

Structure

Product Details

Description

Sitsirikine isolated from the herbs of Catharanthus roseus.

Synonyms

(16R)-18,19-Didehydro-17-hydroxycorynan-16-carboxylic acid methyl ester

IUPAC Name

methyl (2R)-2-[(2S,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate

Molecular Weight

354.5

Molecular Formula

C21H26N2O3

Canonical SMILES

COC(=O)C(CO)C1CC2C3=C(CCN2CC1C=C)C4=CC=CC=C4N3

InChI

InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,13,16-17,19,22,24H,1,8-12H2,2H3/t13-,16-,17-,19-/m0/s1

InChIKey

JGKCGXVOATXMRM-UHEFJODHSA-N

Boiling Point

545.4±50.0°C (Predicted)

Melting Point

239-241°C (Decomposition)

Purity

0.95

Density

1.25±0.1 g/cm3(Predicted)

Appearance

Powder

Form

Powder

pKa

14.30±0.10(Predicted)

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