(-)-Epipodophyllotoxin
Grundinformationen
- CAS
4375-07-9- Standard-SMILES
COc1cc([C@@H]2c3cc4c(cc3[C@@H](O)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1OC- InChIKey
YJGVMLPVUAXIQN-LGWHJFRWSA-N- Summenformel
- C22H22O8
- Durchschnittliche Molmasse
- 414,4 g/mol
- Monoisotopische Masse
- 414,13146766
Überblick
epipodophyllotoxin has been reported in Juniperus sabina and Podophyllum peltatum with data available.
Namen und Bezeichner
- Bevorzugter Name
- (-)-Epipodophyllotoxin
- IUPAC
- (5S,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
- Englischer Name
- Epipodophyllotoxin
- Summenformel
- C22H22O8
- Molmasse
- 414.41
Namen und Synonyme
Epipodophyllotoxin(-)-epipodophyllotoxin4375-07-9DTXSID10859440(5S,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one(5S,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-(2)benzofuro(5,6-f)(1,3)benzodioxol-8-oneRefChem:67813DTXCID201768213Eipodophyllotoxin(5R,5aR,8aR,9S)-9-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-oneFuro[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one,5,8,8a,9-tetrahydro-9-hydroxy-5-(3,4,5-trimethoxyphenyl)-, (5R,5aR,8aR,9S)-BRN 0099162
Weitere Namen anzeigen
Podophyllotoxin 9-Epimer(5R)-5,8,8aβ,9-Tetrahydro-9α-hydroxy-5β-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-(5aαH)-one(5R)-5,5aα,8aβ,9-Tetrahydro-9α-hydroxy-5β-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-6(8H)-one(5S,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-8-one
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2
- Polarare Oberfläche (TPSA)
- 92,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 30
- Formalladung
- 0
- Komplexität
- 629
Physikochemische Eigenschaften
- Schmelzpunkt
- 160.3 °C · 160.3°C
- Siedepunkt
- 453.31 °C · 453.31°C (rough estimate)
- Dichte
- 1.2649 · 1.2649 (rough estimate)
- Brechungsindex
- 1.448 · 1.4480 (estimate)
- storage temp.
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 13.26 · 13.26±0.40(Predicted)
- Farbe
- White to Off-White
- Stabilität
- Hygroscopic
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Agents obtained from higher plants that have demonstrable cytostatic or antineoplastic activity.
Agents that soften, separate, and cause desquamation of the cornified epithelium or horny layer of skin. They are used to expose mycelia of infecting fungi or to treat corns, warts, and certain other skin diseases.
Agents that interact with TUBULIN to inhibit or promote polymerization of MICROTUBULES.
Anwendungen
VerwendenEpipodophyllotoxins is a naturally occuring antitumors agent extracted from Mayapple plant.
Anbieter60 Anbieter
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
銘瑞集團有限公司17318633522 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
成都健腾生物技术有限公司028-85159085 18080455027 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Zugehörige Reaktionen
0
Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.
Notizen zur Verbindung
Wird geladen…