Acetyl-trans-resveratrol
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Acetyl-trans-resveratrol
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CAS No:
42206-94-0
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Formula:
C20H18O6
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Chemical Name:
Acetyl-trans-resveratrol
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Synonyms:
Acetyl-resveratrol,AcetylTrans-resveratrol;3,4',5-Triacetoxy-trans-stilbene 98+%;trans-Resveratrol Triacetate;trans-Triacetylresveratrol, trans-Resveratrol triacetate, 4-[(E)-2-(3,5-Diacetoxphenyl)vinyl]phenyl acetate;3,4',5-Triacetoxy-trans-stilbene;3,5,4'-Tri-O-acetylresveratrol;5-[(1E)-2-[4-(Acetyloxy)phenyl]ethenyl]-1,3-benzenediol1,3-Diacetate;Resveratrol 3,5,4'-triacetate
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CAS No:
Description
Triacetylresveratrol, an acetylated analog of Resveratrol. Triacetylresveratrol decreases the phosphorylation of STAT3 and NF-κB in a dose- and time- dependent manner in PANC-1 and BxPC-3 cells. Anticancer effects[1].
Acetic acid [4-[2-(3,5-diacetyloxyphenyl)ethenyl]phenyl] ester is a stilbenoid.
Characteristics
78.9
3.4
white to tan
1.2±0.1 g/cm3
117.0 to 121.0 °C
504.8°C at 760 mmHg
221.4±30.2 °C
1.600
DMSO: ≥18mg/mL
room temp
171.1 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Safety Information
Ⅲ
UN 3077 9 / PGIII
3
37/38-41-43-50/53
26-36/37/39-60-61
Xi,N
P261-P273-P280-P305 + P351 + P338
H315-H317-H318-H335-H400
|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P333+P313, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Acetyl-trans-resveratrol Use and Manufacturing
trans-Resveratrol Triacetate is the acetylated analogue of Resveratrol (R150000) that is a natural antioxidant and a potential radioprotective agent. trans-Resveratrol Triacetate induces p53 activity and inhibits proliferation in breast and prostate tumor cell lines.
Computed Properties
Molecular Weight:354.4
XLogP3:3.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:354.11033829
Monoisotopic Mass:354.11033829
Topological Polar Surface Area:78.9
Heavy Atom Count:26
Complexity:508
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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