| SpectraBase Compound ID | FHBUkRJXxZB |
|---|---|
| InChI | InChI=1S/C36H60O9/c1-19-26(41)27(42)28(43)30(44-19)45-25-9-10-32(4)23(33(25,5)17-37)8-11-34(6)29(32)22(39)14-20-21-15-31(2,3)12-13-36(21,18-38)24(40)16-35(20,34)7/h14,19,21-30,37-43H,8-13,15-18H2,1-7H3/t19-,21+,22-,23-,24+,25+,26+,27+,28-,29-,30+,32+,33+,34-,35-,36-/m1/s1 |
| InChIKey | SJNZYLBAMONADI-OXJIFADESA-N |
| Mol Weight | 636.9 g/mol |
| Molecular Formula | C36H60O9 |
| Exact Mass | 636.423734 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HiSha8JtBxJ |
|---|---|
| Name | PLEUROSAPONIN-F;3-O-BETA-D-FUCOPYRANOSYL-3-BETA,11-ALPHA,16-BETA,23,28-PENTAHYDROXY-OLEAN-12-EN |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H60O9 |
| InChI | InChI=1S/C36H60O9/c1-19-26(41)27(42)28(43)30(44-19)45-25-9-10-32(4)23(33(25,5)17-37)8-11-34(6)29(32)22(39)14-20-21-15-31(2,3)12-13-36(21,18-38)24(40)16-35(20,34)7/h14,19,21-30,37-43H,8-13,15-18H2,1-7H3/t19-,21+,22-,23-,24+,25+,26+,27+,28-,29-,30+,32+,33+,34-,35-,36-/m1/s1 |
| InChIKey | SJNZYLBAMONADI-OXJIFADESA-N |
| Literature Reference Author | I.K.LEE,S.U.CHOI,K.R.LEE |
| Literature Reference Citation | CHEM.PHARM.BULL.,60,1011(2012) |
| Literature Reference DOI | 10.1248/cpb.c12-00274 |
| Molecular Weight | 636.867 g/mol |
| Source File Reference | UWBT4485 |