(10R,11S,15R,16R)-16-hydroxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one | CAS No. 477-47-4

(10R,11S,15R,16R)-16-hydroxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one

Basic Information

CAS Number

477-47-4

Molecular Formula

C22H22O8

Molecular Weight

414.41 g/mol

AD

Basic Physical Properties

Melting Point

225-227℃

Boiling Point

597.9°C at 760 mmHg

Flash Point

210.2°C

Solubility

H2O: soluble

Refractive Index

1.4480 (estimate)

Specific Rotation

D20 +9.4° (c = 0.7 in chloroform)

COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O

InChI

InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19+,20-/m0/s1

InChIKey

YJGVMLPVUAXIQN-HAEOHBJNSA-N

LogP

2.4092000000000002

Topological Polar Surface Area

92.68 Ų

Hydrogen Bond Donor/Acceptor

1 / 8

Complexity

629

Safety Information

View Safety Information

GHS Hazard Pictograms

H301H301
H312H312
H315H315
H319H319
H335H335

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral
H312 Harmful in contact with skin
Acute toxicity, dermal
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 6.1 Class 6.1

Storage Conditions

2-8℃

Sensitiveness

Light Sensitive

Synonyms & References

English

  • NSC36407
  • IGF-1R Inhibitor, PPP
  • Picropodophyllotoxin, >=96% (HPLC), powder
  • picro-podophyllin
  • DTXSID80197245
  • KBioSS_002116
  • 17434-18-3
  • KBio2_002116
  • AXL1717;Picropodophyllin;PPP
  • s7668
  • (5R,5aR,8aS,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
  • SPECTRUM1504410
  • BRN 0099161
  • cyclolignan PPP
  • NSC799342
  • Picropodophyllotoxin
  • CS-1184
  • SCHEMBL159598
  • 0F35AOI227
  • BS-16874
  • (-)PPP
  • HMS1923O05
  • (5R,5aR,8aS,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-8-one
  • Picropodophyllin (PPP)
  • UNII-0F35AOI227
  • KBioGR_002538
  • KBio2_007252
  • CHEMBL283120
  • GTPL7873
  • SPBio_000479
  • AXL1717 (Picropodophyllotoxin)

MDL Number

MFCD01742647

FAQ

What is (10R,11S,15R,16R)-16-hydroxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one (CAS: 477-47-4)?

This compound is a cyclic organic molecule with a specific stereochemistry and functional groups. It contains a tricyclic core with hydroxyl, methoxy, and oxo functionalities. It is characterized by its unique structural features and is used in various applications.

What are the main uses of (10R,11S,15R,16R)-16-hydroxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one (CAS: 477-47-4)?

This compound is primarily used in the pharmaceutical industry as an intermediate in the synthesis of other active pharmaceutical ingredients (APIs). It may also be used in research and development for drug discovery and as a reagent in organic synthesis.

Is (10R,11S,15R,16R)-16-hydroxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one (CAS: 477-47-4) safe?

The safety of this compound depends on the specific use and handling conditions. Proper protective measures should be taken, including the use of gloves, goggles, and appropriate ventilation. It is recommended to follow chemical safety guidelines and consult material safety data sheets (MSDS) for more detailed information.

How should (10R,11S,15R,16R)-16-hydroxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one (CAS: 477-47-4) be stored?

This compound should be stored in a cool, dry place, protected from light and moisture. It should be kept in a tightly sealed container to prevent degradation. The storage temperature should be below 25°C to ensure stability and safety. It is important to follow the manufacturer's storage recommendations and local regulations for handling and disposing of chemicals.

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