ST066914 Podophyllotoxin

MW: 414.41

CAS: 518-28-5

MDL: MFCD00601260

TNP: TNP00237

5,8,8a,9-tetrahydro-9-hydroxy-5- (3,4,5-trimethoxyphenyl)-furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5ah)-one; (5R,5AR,8AR,9R)-9-HYDROXY-5-(3,4,5-TRIMETHOXY-PHENYL)-5,8,8A,9-TETRAHYDRO-5AH-FURO[3',4':6,7]NAPHTHO[2,3-D][1,3]DIOXOL-6-ONE; 4,5-trimethoxyphenyl

LogP: 3.21

LogS: -4.62

Acceptors: 8

Donors: 1

Rotation Bonds: 2

Chiral Centers: 4

N+O: 8

LIPINSKY: 4

Info: Podophyllotoxin 95%

IUPAC: (5R,9R,5aR,8aR)-9-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,8,9,5a,8a-pentahydro-2H -isobenzofurano[5',6'-2,1]benzo[4,5-d]1,3-dioxolan-6-one

Smiles: c12c([C@H](O)[C@@H]3[C@@H]([C@@H]1c1cc(OC)c(c(c1)OC)OC)C(=O)OC3)cc1c(c2)OCO1

Specification: Plant Oils, Toxins, Phenolic Acids & Derivatives; Natural Plant Extract; Microtobule InhibitorsCancer Research; Microtubule Inhibitors; Antitumor Agents; Cell Signaling and Neuroscience; Cytoskeleton and Extracellular Matrix (5R,5aR,8aR,9R)-5,8,8a,9-Tetrahydro-9-hydroxy-5-(3,4,5-trimethoxyphenyl)-furo(3',4':6,7)naphtho[2,3-d]-1,3-dioxol-6(5aH)-one Chemical Properties:

mp 183-184 C(lit.) alpha -110.7

Chemical Compounds - Natural Compounds