[20,22,23,25-Tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-9-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] furan-3-carboxylate
Grundinformationen
- CAS
256937-98-1- Standard-SMILES
CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cnccc1CCC(C)C(=O)OC(C(OC(=O)c1ccoc1)C2OC(C)=O)C4(C)O- InChIKey
MULDBYDFNDGEHV-UHFFFAOYSA-N- Summenformel
- C41H47NO19
- Durchschnittliche Molmasse
- 857,8 g/mol
Namen und Bezeichner
- Bevorzugter Name
- [20,22,23,25-Tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-9-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] furan-3-carboxylate
- IUPAC
- [20,22,23,25-tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-9-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] furan-3-carboxylate
- Englischer Name
- 3-Furancarboxylic acid, (7S,10S,11S,12S,13R,14S,15R,16R,17R,22R,23R,24R)-14,15,22,23-tetrakis(acetyloxy)-13-[(acetyloxy)methyl]-5,7,8,10,11,13,14,15,16,17,18,20-dodecahydro-11-hydroxy-7,11,17-trimethyl-8,20-dioxo-12,17-epoxy-10,13-ethano-12,16-methano-6H,12H-[1,9]dioxacyclooctadecino[3,4-c]pyridin-24-yl ester
- Summenformel
- C41H47NO19
- Molmasse
- 857.82
Namen und Synonyme
Wilfordinine D3-Furancarboxylic acid, (7S,10S,11S,12S,13R,14S,15R,16R,17R,22R,23R,24R)-14,15,22,23-tetrakis(acetyloxy)-13-[(acetyloxy)methyl]-5,7,8,10,11,13,14,15,16,17,18,20-dodecahydro-11-hydroxy-7,11,17-trimethyl-8,20-dioxo-12,17-epoxy-10,13-ethano-12,16-methano-6H,12H-[1,9]dioxacyclooctadecino[3,4-c]pyridin-2...3-Furancarboxylic acid, (7S,10S,11S,12S,13R,14S,15R,16R,17R,22R,23R,24R)-14,15,22,23-tetrakis(acetyloxy)-13-[(acetyloxy)methyl]-5,7,8,10,11,13,14,15,16,17,18,20-dodecahydro-11-hydroxy-7,11,17-trimethyl-8,20-dioxo-12,17-epoxy-10,13-ethano-12,16-methano-6H,12H-[1,9]dioxacyclooctadecino[3,4-c]pyridin-24-yl ester3-Furancarboxylic acid, (7S,10S,11S,12S,13R,14S,15R,16R,17R,22R,23R,24R)-14,15,22,23-tetrakis(acetyloxy)-13-[(acetyloxy)methyl]-5,7,8,10,11,13,14,15,16,17,18,20-dodecahydro-11-hydroxy-7,11,17-trimethyl-8,20-dioxo-12,17-epoxy-10,13-ethano-12,16-methano-6H,12H-[1,9]dioxacyclooctadecino[3,4-c]pyridin-2... USP/EP/BP
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,2
- Polarare Oberfläche (TPSA)
- 266 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 20
- Frei drehbare Bindungen
- 14
- Schwere Atome
- 61
- Formalladung
- 0
- Komplexität
- 1.790
Physikochemische Eigenschaften
- Siedepunkt
- 858.6 · 858.6±65.0 °C(Predicted)
- Dichte
- 1.43 · 1.43±0.1 g/cm3(Predicted)
- pka
- 11.59 · 11.59±0.70(Predicted)
Chemie und Industrie
Anbieter12 Anbieter
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