| SpectraBase Compound ID | 7deFlhMqeZB |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-21(2)10-9-14-25(3)16-19-28(6)23-13-15-29(7)22(11-12-24(31)30(29,8)32)27(23,5)18-17-26(28,4)20-25/h10,22-23,32H,9,11-20H2,1-8H3/t22-,23-,25+,26-,27-,28+,29-,30-/m0/s1 |
| InChIKey | SLSZTYZQTXBSEG-XWWGUGFNSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KTL1L4W8gEC |
|---|---|
| Name | ASTERTARONE-B;4-BETA-HYDROXY-4-EPISHION-21-EN-3-ONE;4-BETA-HYDROXY-4-EPISHIONONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-21(2)10-9-14-25(3)16-19-28(6)23-13-15-29(7)22(11-12-24(31)30(29,8)32)27(23,5)18-17-26(28,4)20-25/h10,22-23,32H,9,11-20H2,1-8H3/t22-,23-,25+,26-,27-,28+,29-,30-/m0/s1 |
| InChIKey | SLSZTYZQTXBSEG-XWWGUGFNSA-N |
| Literature Reference Author | T.AKIHISA,Y.KIMURA,T.TAI,K.ARAI |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1161(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1161 |
| Molecular Weight | 442.726 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU8205 |