| SpectraBase Compound ID | 7gK80LK3Bzp |
|---|---|
| InChI | InChI=1S/C37H46O15/c1-17-26-28(48-19(3)39)31(49-20(4)40)35(9)24(47-18(2)38)15-25-36(16-46-25,52-22(6)42)29(35)32(50-21(5)41)37(45,34(26,7)8)30(27(17)43)51-33(44)23-13-11-10-12-14-23/h10-14,24-25,27-32,43,45H,15-16H2,1-9H3/t24-,25+,27+,28+,29-,30-,31-,32-,35+,36-,37+/m0/s1 |
| InChIKey | SNLZFHVXSDOFFU-DNYCPWKRSA-N |
| Mol Weight | 730.8 g/mol |
| Molecular Formula | C37H46O15 |
| Exact Mass | 730.283671 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L3y3NqGbZMw |
|---|---|
| Name | 14-BETA-BENZOYLOXY-13-DEACETYL-BACCATIN_IV |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H46O15 |
| InChI | InChI=1S/C37H46O15/c1-17-26-28(48-19(3)39)31(49-20(4)40)35(9)24(47-18(2)38)15-25-36(16-46-25,52-22(6)42)29(35)32(50-21(5)41)37(45,34(26,7)8)30(27(17)43)51-33(44)23-13-11-10-12-14-23/h10-14,24-25,27-32,43,45H,15-16H2,1-9H3/t24-,25+,27+,28+,29-,30-,31-,32-,35+,36-,37+/m0/s1 |
| InChIKey | SNLZFHVXSDOFFU-DNYCPWKRSA-N |
| Literature Reference Author | F.S.WANG,L.Y.PENG,Y.ZHAO,G.XU,Q.S.ZHAO,H.D.SUN |
| Literature Reference Citation | J.NAT.PROD.,67,905(2004) |
| Literature Reference DOI | 10.1021/np034042n |
| Molecular Weight | 730.763 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ5590 |