John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5jL0n9fS8C4 SpectraBase Spectrum ID=LRiVzNulyyU

(accessed ).
7-ALPHA,17,18-TRIACETATE-16-ALPHA-HYDROXY-ENT-KAURANE
SpectraBase Compound ID 5jL0n9fS8C4
InChI InChI=1S/C26H40O7/c1-16(27)31-14-23(4)9-6-10-24(5)20-8-7-19-12-25(20,13-26(19,30)15-32-17(2)28)22(11-21(23)24)33-18(3)29/h19-22,30H,6-15H2,1-5H3/t19-,20+,21?,22-,23-,24+,25-,26+/m1/s1
InChIKey SBRWTOGJFGSLAI-AUAUYLGWSA-N
Mol Weight 464.6 g/mol
Molecular Formula C26H40O7
Exact Mass 464.277404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRiVzNulyyU
Name 7-ALPHA,17,18-TRIACETATE-16-ALPHA-HYDROXY-ENT-KAURANE
Compound Number 13
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40O7
InChI InChI=1S/C26H40O7/c1-16(27)31-14-23(4)9-6-10-24(5)20-8-7-19-12-25(20,13-26(19,30)15-32-17(2)28)22(11-21(23)24)33-18(3)29/h19-22,30H,6-15H2,1-5H3/t19-,20+,21?,22-,23-,24+,25-,26+/m1/s1
InChIKey SBRWTOGJFGSLAI-AUAUYLGWSA-N
Literature Reference Author B.M.FRAGA,L.ALVAREZ,S.SUAREZ
Literature Reference Citation J.NAT.PROD.,66,327(2003)
Literature Reference DOI 10.1021/np020420x
Molecular Weight 464.599 g/mol
Solvent CDCl3
Source File Reference UWSI4591
SpectraBase Batch ID F3Ff9maJb6Q