8α-Hydroxylabda-13(16),14-dien-19-yl p-hydroxycinnamate

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$519	In stock

Category

Diterpenoids

Cat.No.

NP1687

CAS

117254-98-5

Product Name

8α-Hydroxylabda-13(16),14-dien-19-yl p-hydroxycinnamate

Structure

Product Details

Description

8α-Hydroxylabda-13(16),14-dien-19-yl p-hydroxycinnamate is a natural diterpenoid found in the herbs of Metasequoia glyptostroboides.

Synonyms

8alpha-Hydroxylabda-13(16),14-dien-19-yl p-hydroxycinnamate

IUPAC Name

[(4aS,5R,6S,8aR)-6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

Molecular Weight

452.63

Molecular Formula

C29H40O4

Canonical SMILES

CC1(CCCC2(C1CCC(C2CCC(=C)C=C)(C)O)C)COC(=O)C=CC3=CC=C(C=C3)O

InChI

InChI=1S/C29H40O4/c1-6-21(2)8-14-25-28(4)18-7-17-27(3,24(28)16-19-29(25,5)32)20-33-26(31)15-11-22-9-12-23(30)13-10-22/h6,9-13,15,24-25,30,32H,1-2,7-8,14,16-20H2,3-5H3/b15-11+/t24-,25+,27?,28-,29-/m0/s1

InChIKey

LXORINFASUBZBQ-WCZLRCKKSA-N

Boiling Point

571.1±25.0 °C(Predicted)

Melting Point

218 °C

Purity

>95%

Density

1.063±0.06 g/cm3(Predicted)

Appearance

Powder

Color

Yellow

Form

Powder

Packaging

1 mg

pKa

9.69±0.26(Predicted)

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