| SpectraBase Compound ID | 8kzC9KJFmCI |
|---|---|
| InChI | InChI=1S/C21H28O6/c1-11(22)27-16-5-7-19(2,3)21(25)10-14(23)17-13(20(16,21)4)9-15-12(18(17)24)6-8-26-15/h6,8,13-14,16-17,23,25H,5,7,9-10H2,1-4H3/t13-,14-,16-,17-,20-,21+/m0/s1 |
| InChIKey | IBALQPBIWZLHPR-SJEMMDPOSA-N |
| Mol Weight | 376.45 g/mol |
| Molecular Formula | C21H28O6 |
| Exact Mass | 376.188589 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4IsNB2q4iNV |
|---|---|
| Name | NORCAESALPININ_E;17-NORBONDUCELLPIN_C |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O6 |
| InChI | InChI=1S/C21H28O6/c1-11(22)27-16-5-7-19(2,3)21(25)10-14(23)17-13(20(16,21)4)9-15-12(18(17)24)6-8-26-15/h6,8,13-14,16-17,23,25H,5,7,9-10H2,1-4H3/t13-,14-,16-,17-,20-,21+/m0/s1 |
| InChIKey | IBALQPBIWZLHPR-SJEMMDPOSA-N |
| Literature Reference Author | T.Z.LINN,S.AWALE,Y.TEZUKA,A.H.BANSKOTA,S.K.KALAUNI,F.ATTAMIM I,J.Y.UEDA,P.B.S.ASI |
| Literature Reference Citation | J.NAT.PROD.,68,706(2005) |
| Literature Reference DOI | 10.1021/np0401720 |
| Molecular Weight | 376.450 g/mol |
| Solvent | CDCl3 |