| SpectraBase Compound ID | Jeh7sMwFfUx |
|---|---|
| InChI | InChI=1S/C30H48O2/c1-19(2)22-12-16-30(8)24(28(22,6)15-13-25(31)32)10-9-23-26-21(4)20(3)11-14-27(26,5)17-18-29(23,30)7/h21-24,26H,1,3,9-18H2,2,4-8H3,(H,31,32)/t21-,22-,23+,24+,26-,27+,28-,29+,30+/m0/s1 |
| InChIKey | KAKDSTYYULDNHW-MHISZOMXSA-N |
| Mol Weight | 440.7 g/mol |
| Molecular Formula | C30H48O2 |
| Exact Mass | 440.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2oiepMKwAyB |
|---|---|
| Name | 3,4-SECO-URS-4-(23),20-(30)-DIEN-3-OIC_ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O2 |
| InChI | InChI=1S/C30H48O2/c1-19(2)22-12-16-30(8)24(28(22,6)15-13-25(31)32)10-9-23-26-21(4)20(3)11-14-27(26,5)17-18-29(23,30)7/h21-24,26H,1,3,9-18H2,2,4-8H3,(H,31,32)/t21-,22-,23+,24+,26-,27+,28-,29+,30+/m0/s1 |
| InChIKey | KAKDSTYYULDNHW-MHISZOMXSA-N |
| Literature Reference Author | Y.KASHIWADA,M.SEKIYA,K.YAMAZAKI,Y.IKESHIRO,T.FUJIOKA,T.YAMAG ISHI,S.KITAGAWA,Y.TA |
| Literature Reference Citation | J.NAT.PROD.,70,623(2007) |
| Literature Reference DOI | 10.1021/np060631s |
| Molecular Weight | 440.710 g/mol |
| Sample ID | 30165 |
| Solvent | C5D5N |