Sootepin D

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$519	In stock

Category

Terpenes

Cat.No.

NP6524

CAS

1154518-97-4

Product Name

Sootepin D

Structure

Product Details

Description

Sootepin D is a natural compound isolated from the fruits of Gardenia jasminoides Ellis.

Synonyms

Sootepin D; 1154518-97-4; methyl 3-[(1S,4R,5R,8S,9S,12R,13R)-12-(3-hydroxyprop-1-en-2-yl)-4,8-dimethyl-5-[(E,2R)-6-methyl-7-oxohept-5-en-2-yl]-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoate; CHEMBL552070; ZINC96023730

IUPAC Name

methyl 3-[(1S,4R,5R,8S,9S,12R,13R)-12-(3-hydroxyprop-1-en-2-yl)-4,8-dimethyl-5-[(E,2R)-6-methyl-7-oxohept-5-en-2-yl]-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoate

Molecular Weight

484.721

Molecular Formula

C31H48O4

Canonical SMILES

CC(CCC=C(C)C=O)C1CCC2(C1(CCC34C2CCC(C3(C4)CCC(=O)OC)C(=C)CO)C)C

InChI

InChI=1S/C31H48O4/c1-21(18-32)8-7-9-22(2)24-12-14-29(5)26-11-10-25(23(3)19-33)30(15-13-27(34)35-6)20-31(26,30)17-16-28(24,29)4/h8,18,22,24-26,33H,3,7,9-17,19-20H2,1-2,4-6H3/b21-8+/t22-,24-,25+,26+,28-,29+,30-,31+/m1/s1

InChIKey

ILOHMDKQENYFEG-YSIJHDMVSA-N

Purity

93.0%

Appearance

Oil

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