ChemNet > CAS > 162808-62-0 Caspofungin

162808-62-0 Caspofungin

product Name	Caspofungin
CAS No	162808-62-0
Synonyms	Caspofungine; CASPORFUNGIN; N-{(2R,9S,11R,12R,14aS,15S,20S,25aS)-12-[(2-aminoethyl)amino]-20-[(1R)-3-amino-1-hydroxypropyl]-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,15-trihydroxy-6-[(1R)-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
Molecular Formula	C₅₂H₈₈N₁₀O₁₅
Molecular Weight	1093.3131
InChI	InChI=1/C52H88N10O15/c1-5-28(2)24-29(3)12-10-8-6-7-9-11-13-39(69)56-34-26-38(68)46(55-22-21-54)60-50(75)43-37(67)19-23-61(43)52(77)41(36(66)18-20-53)58-49(74)42(45(71)44(70)31-14-16-32(64)17-15-31)59-48(73)35-25-33(65)27-62(35)51(76)40(30(4)63)57-47(34)72/h14-17,28-30,33-38,40-46,55,63-68,70-71H,5-13,18-27,53-54H2,1-4H3,(H,56,69)(H,57,72)(H,58,74)(H,59,73)(H,60,75)/t28?,29?,30-,33-,34+,35+,36-,37+,38-,40?,41+,42?,43+,44+,45+,46-/m1/s1
Molecular Structure
Density	1.36g/cm³
Boiling point	1408.1°C at 760 mmHg
Refractive index	1.623
Flash point	805.4°C
Vapour Pressur	0mmHg at 25°C
Hazard Symbols
Risk Codes
Safety Description

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