Ustusolate A

For Research Use Only.
Category
Sesquiterpenoids
Cat.No.
NP5959
CAS
1136611-58-9
Product Name
Ustusolate A
Structure

Product Details

Description
Ustusolate A is produced by Aspergillus ustus and exerts weak cytotoxicity against HL-60 and A549 cells with IC50 values of 20.6 and 30.0 microM, respectively.
Synonyms
6-O-(octa-2E,4E,6E-trienoyl)-12-hydroxy-6-epi-albrassitriol; 2,4,6-Octatrienoic acid, (1R,4S,4aS,8aS)-1,4,4a,5,6,7,8,8a-octahydro-4-hydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-1-naphthalenyl ester, (2E,4E,6E)-
IUPAC Name
[(1R,4S,4aS,8aS)-4-hydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1H-naphthalen-1-yl] (2E,4E,6E)-octa-2,4,6-trienoate
Molecular Weight
390.51
Molecular Formula
C23H34O5
Canonical SMILES
CC=CC=CC=CC(=O)OC1C=C(C(C2(C1C(CCC2)(C)C)C)(CO)O)CO
InChI
InChI=1S/C23H34O5/c1-5-6-7-8-9-11-19(26)28-18-14-17(15-24)23(27,16-25)22(4)13-10-12-21(2,3)20(18)22/h5-9,11,14,18,20,24-25,27H,10,12-13,15-16H2,1-4H3/b6-5+,8-7+,11-9+/t18-,20+,22+,23-/m1/s1
InChIKey
VYUGROORELIDOB-MOHQOPMHSA-N
Boiling Point
542.4±50.0°C (Predicted)
Purity
≥98%
Density
1.15±0.1 g/cm3 (Predicted)
Solubility
Soluble in Methanol
Appearance
Oily Matter
Storage
Store at 2-8°C
Form
Oil
Packaging
1 mg
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