Basic information
- CAS
61276-17-3- Standard SMILES
CC1OC(OC2C(O)C(OCCc3ccc(O)c(O)c3)OC(CO)C2OC(=O)/C=C/c2ccc(O)c(O)c2)C(O)C(O)C1O- InChIKey
FBSKJMQYURKNSU-QPJJXVBHSA-N- Molecular formula
- C29H36O15
- Average molar mass
- 624.6 g/mol
- Monoisotopic mass
- 624.20542044
Names & identifiers
- Preferred name
- [6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
- IUPAC
- [6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
- English name
- Verbascoside
- Molecular formula
- C29H36O15
- Molecular weight
- 624.59
Names & synonyms
NSC603831SCHEMBL13978365HMS5084N04.beta.-D-Glucopyranoside,4-dihydroxyphenyl)ethyl-3-O-(6-deoxy-.alpha.-L- mannopyranosyl)-, 4-[3-(3,4-dihydroxyphenyl)-2- propenoate], (E)-ACTEOSIDEAcetosideISOVERBASCOSIDEKUSAGININKusagiTJC 160NSC 603831Russetinol
Show more names
VerbacosideVERBASCOSIDE
Database identifiers
- CAS
61276-17-3- PubChem CID
- 5459010
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 245 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 11
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 936
Physicochemical properties
- Melting point
- 232 ℃ · 232℃
- Boiling point
- 908.8 · 908.8±65.0 °C(Predicted)
- Density
- 1.6 · 1.60±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Ethyl Acetate (Very Slightly), Methanol (Slightly)
- pka
- 9.31 · 9.31±0.10(Predicted)
- form
- Solid
- color
- White to Pale Yellow
- Stability
- Hygroscopic
- Major Application
- metabolomicsvitamins, nutraceuticals, and natural products
- Cosmetics Ingredients Functions
- CHELATINGSKIN PROTECTINGANTIOXIDANTBLEACHING
- InChIKey
- FBSKJMQYURKNSU-ZLSOWSIRSA-N
- SMILES
- O([C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1OC(=O)/C=C/C1C=CC(=C(C=1)O)O)CO)OCCC1C=CC(=C(C=1)O)O)O
- LogP
- 0.077 · 0.077 (est)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 2
- rtecs
- LZ5786000
- hs_code
- 29389090
- Toxicity
- LD50 oral in rat: > 5gm/kg
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Applications
DescriptionVerbascoside is isolated from Lantana camara, acts as an ATP-competitive inhibitor of PKC, with an IC50 of 25 µM, and has antitumor, anti-inflammatory and antineuropathic pain activity.
UsesVerbascoside is an agent producing effects on anti-GBM nephritis in rats. Effective agent against glomerulonephritis. Phenolic anti-oxidant agent.
Suppliers101 total
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
山西玉宁生物科技有限公司13623677056 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
南京普怡生物科技有限公司13814510036 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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