| SpectraBase Compound ID | 1uW9iirDIu4 |
|---|---|
| InChI | InChI=1S/C25H32O9/c1-12(26)32-20-21(33-13(2)27)23(4,5)25(30)9-7-15-17(24(25,6)22(20)34-14(3)28)11-18-16(19(15)29)8-10-31-18/h8,10,15,17,20-22,30H,7,9,11H2,1-6H3/t15-,17+,20+,21-,22+,24+,25-/m1/s1 |
| InChIKey | SJZIFWGVHGVKAH-AVZLBZSXSA-N |
| Mol Weight | 476.5 g/mol |
| Molecular Formula | C25H32O9 |
| Exact Mass | 476.204633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3eyLPOtawk |
|---|---|
| Name | NORCAESALPININ_D;3-O-ACETYL-NORCAESALPININ_A |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32O9 |
| InChI | InChI=1S/C25H32O9/c1-12(26)32-20-21(33-13(2)27)23(4,5)25(30)9-7-15-17(24(25,6)22(20)34-14(3)28)11-18-16(19(15)29)8-10-31-18/h8,10,15,17,20-22,30H,7,9,11H2,1-6H3/t15-,17+,20+,21-,22+,24+,25-/m1/s1 |
| InChIKey | SJZIFWGVHGVKAH-AVZLBZSXSA-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 | 476.524 g/mol |
| Solvent | CDCl3 |