Basic information
- CAS
143615-75-2- Standard SMILES
CCCCCC(CC(CCc1ccc(O)c(OC)c1)OC(C)=O)OC(C)=O- InChIKey
PXBFKEHWQRAQQD-UHFFFAOYSA-N- Molecular formula
- C21H32O6
- Average molar mass
- 380.5 g/mol
Overview
[6]-Gingerdiol 3,5-diacetate is a carboxylic ester.
Names & identifiers
- Preferred name
- [6]-Gingerdiol 3,5-diacetate
- IUPAC
- [3-acetyloxy-1-(4-hydroxy-3-methoxyphenyl)decan-5-yl] acetate
- English name
- Diacetoxy-6-gingerdiol
- Molecular formula
- C21H32O6
- Molecular weight
- 380.48
Names & synonyms
[6]-Gingerdiol 3,5-diacetate[3-acetyloxy-1-(4-hydroxy-3-methoxyphenyl)decan-5-yl] acetate3-(acetyloxy)-1-(4-hydroxy-3-methoxyphenyl)decan-5-yl acetate(6)-Gingerdiol 3,5-diacetate(6)-Gingerdiol 3,5-diacetic acid[6]-Gingerdiol 3,5-diacetic acid3,5-Decanediol, 1-(4-hydroxy-3-methoxyphenyl)-, 3,5-diacetate, (3R,5S)-3,5-Decanediol, 1-(4-hydroxy-3-methoxyphenyl)-, 3,5-diacetate, [R-(R*,S*)]-(3-acetyloxy-1-(4-hydroxy-3-methoxyphenyl)decan-5-yl) acetate3,5-Decanediol, 1-(4-hydroxy-3-methoxyphenyl)-, 3,5-diacetate, (R-(R*,S*))-RefChem:696693-(Acetyloxy)-1-(4-hydroxy-3-methoxyphenyl)decan-5-yl acetic acid
Show more names
Diacetoxy-6-gingerdiol(3R,5S)-[6]-Gingerdiol diacetate
(3R,5S)-1-(4-Hydroxy-3-methoxyphenyl)decane-3,5-diyl diacetatePXBFKEHWQRAQQD-UHFFFAOYSA-NDiacetoxy-6-gingerdioorb3178507SCHEMBL8236669CHEBI:169730TFA61575TN12116
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 82.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 14
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 438
Physicochemical properties
- Boiling point
- 500 · 500.0±50.0 °C(Predicted)
- Density
- 1.085 · 1.085±0.06 g/cm3(Predicted)
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- Oil
- pka
- 10.1 · 10.10±0.20(Predicted)
- color
- White to off-white
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Applications
UsesDiacetoxy-6-gingerdiol is a gingerol isolated with anti-inflammatory and antioxidant effects, which is found in the dichloromethane extract of rhizomes of ginger (Zingiber officinale Roscoe). Diacetoxy-6-gingerdiol protects the extracellular matrix of nucleus pulposus cells and ameliorates intervertebral disc degeneration by inhibiting the IL-1β-mediated NLRP3 pathway[1][2][3].
Suppliers40 total
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
上海纯优生物科技有限公司18302135232 18302135232 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Aladdin Scientific[email protected]
上海晶抗生物工程有限公司021-54721350 13524668266 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
桂林莱科生物科技有限公司18978670903 18107731009 · [email protected]
Related reactions
0 records
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Compound notes
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