| product Name |
Pneumocandin B0 |
| Synonyms |
Pneumocardin B0; pneumocandin B(0); N-{(2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-[(1S)-3-amino-1-hydroxy-3-oxopropyl]-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,12,15-tetrahydroxy-6-[(1S)-1-hydroxyethyl]-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl}-10,12-dimethyltetradecanamide; Pneumocandin BO |
| Molecular Formula |
C50H80N8O17 |
| Molecular Weight |
1065.2136 |
| InChI |
InChI=1/C50H80N8O17/c1-5-25(2)20-26(3)12-10-8-6-7-9-11-13-37(66)52-31-22-35(64)46(71)56-48(73)41-33(62)18-19-57(41)50(75)39(34(63)23-36(51)65)54-47(72)40(43(68)42(67)28-14-16-29(60)17-15-28)55-45(70)32-21-30(61)24-58(32)49(74)38(27(4)59)53-44(31)69/h14-17,25-27,30-35,38-43,46,59-64,67-68,71H,5-13,18-24H2,1-4H3,(H2,51,65)(H,52,66)(H,53,69)(H,54,72)(H,55,70)(H,56,73)/t25?,26?,27-,30+,31-,32-,33-,34-,35+,38-,39-,40-,41-,42-,43-,46+/m0/s1 |
| CAS Registry Number |
135575-42-7 |
| Molecular Structure |
|
| Density |
1.41g/cm3 |
| Boiling point |
1442.9°C at 760 mmHg |
| Refractive index |
1.629 |
| Flash point |
826.5°C |
| Vapour Pressur |
0mmHg at 25°C |
| Hazard Symbols |
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| Risk Codes |
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| Safety Description |
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