SpectraBase Spectrum ID |
BoC7uxKLnBN |
Name |
CINNAMTANNIN_D-1 |
Compound Number |
2A |
Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula |
C45H36O18 |
InChI |
InChI=1S/C45H36O18/c46-18-10-27(54)33-31(11-18)62-45(17-3-6-22(49)26(53)9-17)44(59)38(33)36-32(63-45)14-29(56)35-37(39(58)41(61-43(35)36)16-2-5-21(48)25(52)8-16)34-28(55)13-23(50)19-12-30(57)40(60-42(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,30,37-41,44,46-59H,12H2/t30-,37-,38+,39+,40+,41+,44+,45-/m0/s1 |
InChIKey |
BYSRPHRKESMCPO-HMQYECKYSA-N |
Literature Reference Author |
K.B.KILLDAY,M.H.DAVEY,J.A.GLINSKI,P.DUAN,R.VELURI,G.PRONI,F.
J.DAUGHERTY,M.S.TEMP |
Literature Reference Citation |
J.NAT.PROD.,74,1833(2011) |
Literature Reference DOI |
10.1021/np1007944 |
Molecular Weight |
864.770 g/mol |
Sample ID |
39173 |
Solvent |
DMSO-D6 |