SpectraBase Compound ID | 7E8JZ4E5dYR |
---|---|
InChI | InChI=1S/C49H86O12/c1-9-10-11-12-13-14-15-16-20-23-26-29-32-43(34-44(57-39(5)51)33-30-27-24-21-18-17-19-22-25-28-31-37(2)3)35-56-49-48(60-42(8)54)47(59-41(7)53)46(58-40(6)52)45(61-49)36-55-38(4)50/h34,37,44-49H,9-33,35-36H2,1-8H3/b43-34+/t44-,45+,46+,47-,48+,49+/m0/s1 |
InChIKey | PLGJNHZNMVOLHF-HKMQUTJJSA-N |
Mol Weight | 867.2 g/mol |
Molecular Formula | C49H86O12 |
Exact Mass | 866.611928 g/mol |
SpectraBase Spectrum ID | Af3aYNh27tc |
---|---|
Name | CLATHROSIDE_C_PERACETATE |
Compound Number | 4B |
Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C49H86O12 |
InChI | InChI=1S/C49H86O12/c1-9-10-11-12-13-14-15-16-20-23-26-29-32-43(34-44(57-39(5)51)33-30-27-24-21-18-17-19-22-25-28-31-37(2)3)35-56-49-48(60-42(8)54)47(59-41(7)53)46(58-40(6)52)45(61-49)36-55-38(4)50/h34,37,44-49H,9-33,35-36H2,1-8H3/b43-34+/t44-,45+,46+,47-,48+,49+/m0/s1 |
InChIKey | PLGJNHZNMVOLHF-HKMQUTJJSA-N |
Literature Reference Author | V.COSTANTINO,E.FATTORUSSO,C.IMPERATORE,A.MANGONI |
Literature Reference Citation | J.NAT.PROD.,69,73(2006) |
Literature Reference DOI | 10.1021/np050331v |
Molecular Weight | 867.215 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMZ16465 |