SpectraBase Compound ID | KyImSTypXNr |
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InChI | InChI=1S/C26H32O12/c1-12-17-18(20(30)23(12)37-16(28)9-8-13-6-4-3-5-7-13)14(24(33)34-2)11-35-25(17)38-26-22(32)21(31)19(29)15(10-27)36-26/h3-9,11-12,15,17-23,25-27,29-32H,10H2,1-2H3/b9-8+/t12-,15+,17+,18+,19+,20-,21-,22+,23+,25-,26-/m1/s1 |
InChIKey | KWXCZSMMAKGXBP-NFPMQYHBSA-N |
Mol Weight | 536.5 g/mol |
Molecular Formula | C26H32O12 |
Exact Mass | 536.189376 g/mol |
SpectraBase Spectrum ID | 2xenIidGVp3 |
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Name | CAUDATOSIDE-B;7-CINNAMOYL-5-DEOXYPULCHELLOSIDE-I |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C26H32O12 |
InChI | InChI=1S/C26H32O12/c1-12-17-18(20(30)23(12)37-16(28)9-8-13-6-4-3-5-7-13)14(24(33)34-2)11-35-25(17)38-26-22(32)21(31)19(29)15(10-27)36-26/h3-9,11-12,15,17-23,25-27,29-32H,10H2,1-2H3/b9-8+/t12-,15+,17+,18+,19+,20-,21-,22+,23+,25-,26-/m1/s1 |
InChIKey | KWXCZSMMAKGXBP-NFPMQYHBSA-N |
Literature Reference Author | S.AYERS,A.T.SNEDEN |
Literature Reference Citation | J.NAT.PROD.,65,1621(2002) |
Literature Reference DOI | 10.1021/np020211c |
Molecular Weight | 536.533 g/mol |
Solvent | ACETONE-D6 |
Source File Reference | UWSI7202 |