Cabralealactone

Inquiry

For Research Use Only.

Category

Terpenes

Cat.No.

NP6871

CAS

19865-87-3

Product Name

Cabralealactone

Structure

Product Details

Description

Cabralealactone isolated from the herbs of Aglaia lawii. It is exclusively cytotoxic to NCI-H187 cell line.

Synonyms

(5α,17β)-4,4,8,10,14-Pentamethyl-17-[(2S)-2-methyl-5-oxotetrahydr o-2-furanyl]gonan-3-one

IUPAC Name

(5S)-5-methyl-5-[(5R,8R,9R,10R,13R,14R,17S)-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one

Molecular Weight

414.6

Molecular Formula

C27H42O3

Canonical SMILES

CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C5(CCC(=O)O5)C)C)C)C

InChI

InChI=1S/C27H42O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h17-20H,7-16H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1

InChIKey

NOLGXQBEFHYZHI-QPBHWVAKSA-N

Boiling Point

516.8±23.0 °C(Predicted)

Melting Point

183 °C

Purity

98.5%

Density

1.057±0.06 g/cm3(Predicted)

Appearance

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