| SpectraBase Compound ID | G3W17CTgiE9 |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-17-9-12-30(25(34)35)14-13-27(4)19(24(30)18(17)2)7-8-21-28(27,5)11-10-20-26(3,16-31)22(32)15-23(33)29(20,21)6/h7,17-18,20-22,24,31-32H,8-16H2,1-6H3,(H,34,35)/t17-,18+,20+,21+,22+,24+,26+,27-,28-,29+,30+/m1/s1 |
| InChIKey | SIRSUWPEJDNSOZ-HXPMKIGTSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CU3hn58e3iN |
|---|---|
| Name | CHEIRANTHIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-17-9-12-30(25(34)35)14-13-27(4)19(24(30)18(17)2)7-8-21-28(27,5)11-10-20-26(3,16-31)22(32)15-23(33)29(20,21)6/h7,17-18,20-22,24,31-32H,8-16H2,1-6H3,(H,34,35)/t17-,18+,20+,21+,22+,24+,26+,27-,28-,29+,30+/m1/s1 |
| InChIKey | SIRSUWPEJDNSOZ-HXPMKIGTSA-N |
| Literature Reference Author | T.NAKANISHI,Y.INATOMI,H.MURATA,S.S.ISHIDA,Y.FUJINO,K.MIURA,Y .YASUNO,A.INADA,F.A. |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,334(2007) |
| Literature Reference DOI | 10.1248/cpb.55.334 |
| Molecular Weight | 486.692 g/mol |
| Sample ID | 55450 |
| Solvent | CDCl3 |