![3-BETA,6-BETA-DIHYDROXY-7-BETA-[(4-HYDROXYBENZOYL)-OXY]-21-ALPHA-H-24-NORHOPA-4(23),22(29)-DIENE](/api/spectrum/58vqGkNgQ29/structure.png?h=300&w=458 "3-BETA,6-BETA-DIHYDROXY-7-BETA-[(4-HYDROXYBENZOYL)-OXY]-21-ALPHA-H-24-NORHOPA-4(23),22(29)-DIENE")
| SpectraBase Compound ID | 15GZ9aQgtcH |
|---|---|
| InChI | InChI=1S/C36H50O5/c1-20(2)24-14-17-33(4)25(24)15-19-35(6)27(33)12-13-28-34(5)18-16-26(38)21(3)29(34)30(39)31(36(28,35)7)41-32(40)22-8-10-23(37)11-9-22/h8-11,24-31,37-39H,1,3,12-19H2,2,4-7H3/t24-,25?,26-,27?,28?,29?,30-,31-,33-,34+,35+,36-/m0/s1 |
| InChIKey | FKBMDXDGRZSAQH-KKWXRPDRSA-N |
| Mol Weight | 562.8 g/mol |
| Molecular Formula | C36H50O5 |
| Exact Mass | 562.365825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 58vqGkNgQ29 |
|---|---|
| Name | 3-BETA,6-BETA-DIHYDROXY-7-BETA-[(4-HYDROXYBENZOYL)-OXY]-21-ALPHA-H-24-NORHOPA-4(23),22(29)-DIENE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H50O5 |
| InChI | InChI=1S/C36H50O5/c1-20(2)24-14-17-33(4)25(24)15-19-35(6)27(33)12-13-28-34(5)18-16-26(38)21(3)29(34)30(39)31(36(28,35)7)41-32(40)22-8-10-23(37)11-9-22/h8-11,24-31,37-39H,1,3,12-19H2,2,4-7H3/t24-,25?,26-,27?,28?,29?,30-,31-,33-,34+,35+,36-/m0/s1 |
| InChIKey | FKBMDXDGRZSAQH-KKWXRPDRSA-N |
| Literature Reference Author | J.P.CHAVEC,J.M.DAVID,S.W.YANG,G.A.CORDELL |
| Literature Reference Citation | J.NAT.PROD.,60,909(1997) |
| Literature Reference DOI | 10.1021/np970238+ |
| Molecular Weight | 562.790 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS23203 |