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DODECACETYLORMOCARPIN
SpectraBase Compound ID KzbQpuktHyj
InChI InChI=1S/C66H66O32/c1-27(67)81-25-49-59(87-33(7)73)61(89-35(9)75)63(91-37(11)77)65(97-49)93-43-21-45(85-31(5)71)51-47(23-43)95-57(39-13-17-41(18-14-39)83-29(3)69)53(55(51)79)54-56(80)52-46(86-32(6)72)22-44(24-48(52)96-58(54)40-15-19-42(20-16-40)84-30(4)70)94-66-64(92-38(12)78)62(90-36(10)76)60(88-34(8)74)50(98-66)26-82-28(2)68/h13-24,49-50,53-54,57-66H,25-26H2,1-12H3/t49-,50-,53-,54-,57+,58+,59-,60-,61+,62+,63-,64-,65-,66-/m1/s1
InChIKey COIPKPJMCJPEHI-RROLNMJOSA-N
Mol Weight 1371.2 g/mol
Molecular Formula C66H66O32
Exact Mass 1370.35372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BxciQWaAx6
Name DODECACETYLORMOCARPIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H66O32
InChI InChI=1S/C66H66O32/c1-27(67)81-25-49-59(87-33(7)73)61(89-35(9)75)63(91-37(11)77)65(97-49)93-43-21-45(85-31(5)71)51-47(23-43)95-57(39-13-17-41(18-14-39)83-29(3)69)53(55(51)79)54-56(80)52-46(86-32(6)72)22-44(24-48(52)96-58(54)40-15-19-42(20-16-40)84-30(4)70)94-66-64(92-38(12)78)62(90-36(10)76)60(88-34(8)74)50(98-66)26-82-28(2)68/h13-24,49-50,53-54,57-66H,25-26H2,1-12H3/t49-,50-,53-,54-,57+,58+,59-,60-,61+,62+,63-,64-,65-,66-/m1/s1
InChIKey COIPKPJMCJPEHI-RROLNMJOSA-N
Literature Reference Author E.NYANDAT,A.HASSANALI,Y.DEVICENTE,G.MULTARI,C.GALEFFI
Literature Reference Citation PHYTOCHEM.,29,2361(1990)
Literature Reference DOI 10.1016/0031-9422(90)83077-E
Molecular Weight 1371.231 g/mol
Solvent CDCl3
Source File Reference UWMZ21078