| SpectraBase Compound ID | 3pTxt7ER0Sy |
|---|---|
| InChI | InChI=1S/C30H40O8/c1-15(24(35)36)10-16(31)14-27(5,37)19-12-22(34)29(7)28(19,6)21(33)11-18-26(4)9-8-20(32)25(2,3)17(26)13-23-30(18,29)38-23/h11-12,15,17,20,23,32,37H,8-10,13-14H2,1-7H3,(H,35,36)/t15?,17-,20-,23+,26-,27?,28-,29+,30-/m0/s1 |
| InChIKey | RGIUMOMRONDUDR-MLUMXYHLSA-N |
| Mol Weight | 528.6 g/mol |
| Molecular Formula | C30H40O8 |
| Exact Mass | 528.272318 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4fLNbhzt2On |
|---|---|
| Name | APPLANOXIDIC-ACID-D;3-BETA,20-DIHYDROXY-7-ALPHA,8-ALPHA-EPOXY-12,15,23-TRIOXO-5-ALPHA-LANOSTA-9(11),16-DIEN-26-OIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O8 |
| InChI | InChI=1S/C30H40O8/c1-15(24(35)36)10-16(31)14-27(5,37)19-12-22(34)29(7)28(19,6)21(33)11-18-26(4)9-8-20(32)25(2,3)17(26)13-23-30(18,29)38-23/h11-12,15,17,20,23,32,37H,8-10,13-14H2,1-7H3,(H,35,36)/t15?,17-,20-,23+,26-,27?,28-,29+,30-/m0/s1 |
| InChIKey | RGIUMOMRONDUDR-MLUMXYHLSA-N |
| Literature Reference Author | C.T.TOKUYAMA,Y.HAYASHI,M.NISHIZAWA,H.TOKUDA,S.M.CHAIRUL,Y.HA YASHI |
| Literature Reference Citation | PHYTOCHEM.,30,4105(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83476-2 |
| Molecular Weight | 528.643 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU28259 |