Jatrophane 2

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$519	In stock

Category

Diterpenoids

Cat.No.

NP1704

CAS

210108-86-4

Product Name

Jatrophane 2

Structure

Product Details

Description

Jatrophane 2 can be found in the branches of Jatropha carcas L.

Synonyms

2,5,7,8,9,14-Hexaacetoxy-3-benzoyloxy-15-hydroxyjatropha-6(17),11E-diene

IUPAC Name

[(1R,2R,3aR,4S,5S,6E,9S,10S,11S,13R,13aS)-2,4,9,10,11,13-hexaacetyloxy-3a-hydroxy-2,5,8,8-tetramethyl-12-methylidene-3,4,5,9,10,11,13,13a-octahydro-1H-cyclopenta[12]annulen-1-yl] benzoate

Molecular Weight

758.8

Molecular Formula

C39H50O15

Canonical SMILES

CC1C=CC(C(C(C(C(=C)C(C2C(C(CC2(C1OC(=O)C)O)(C)OC(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)(C)C

InChI

InChI=1S/C39H50O15/c1-20-17-18-37(9,10)35(52-26(7)44)32(50-24(5)42)31(49-23(4)41)21(2)30(48-22(3)40)29-34(53-36(46)28-15-13-12-14-16-28)38(11,54-27(8)45)19-39(29,47)33(20)51-25(6)43/h12-18,20,29-35,47H,2,19H2,1,3-11H3/b18-17+/t20-,29-,30-,31-,32+,33-,34+,35+,38+,39+/m0/s1

InChIKey

AHHKCKIAGSAXCR-DXFPZIRUSA-N

Boiling Point

710.0±60.0 °C(Predicted)

Purity

>98%

Density

1.26±0.1 g/cm3(Predicted)

Appearance

Powder

Color

Yellow

Form

Powder

Packaging

1 mg

pKa

12.34±0.70(Predicted)

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