| SpectraBase Spectrum ID |
7ffSjsTnpJd |
| Name |
benzoic acid [(1S,2S,4aS,4bR,8aR,10aR)-1-(benzoyloxymethyl)-8-keto-1,4a,8a-trimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthren-2-yl] ester |
| Compound Number |
5C |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C32H38O5 |
| InChI |
InChI=1S/C32H38O5/c1-30-20-18-27(37-29(35)23-13-8-5-9-14-23)32(3,21-36-28(34)22-11-6-4-7-12-22)25(30)17-19-31(2)24(30)15-10-16-26(31)33/h4-9,11-14,24-25,27H,10,15-21H2,1-3H3/t24-,25-,27+,30-,31-,32-/m1/s1 |
| InChIKey |
OOLLSIJFSMYREO-NGZLQMHNSA-N |
| Literature Reference Author |
A.A.RIBEIRO,Z.SHEN,M.WANG,Y.ZHANG,P.A.ZORETIC |
| Literature Reference Citation |
MAGN.RES.CHEM.,36,325(1998) |
| Literature Reference DOI |
10.1002/(sici)1097-458x(199805)36:5<325::aid-omr268>3.0.co;2-2 |
| Molecular Weight |
502.651 g/mol |
| Solvent |
CDCl3 |
| Source File Reference |
UWRU1108 |
![benzoic acid [(1S,2S,4aS,4bR,8aR,10aR)-1-(benzoyloxymethyl)-8-keto-1,4a,8a-trimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthren-2-yl] ester](/api/spectrum/7ffSjsTnpJd/structure.png?h=300&w=458 "benzoic acid [(1S,2S,4aS,4bR,8aR,10aR)-1-(benzoyloxymethyl)-8-keto-1,4a,8a-trimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthren-2-yl] ester")
