For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
SECODEHYDRO-XESTOVANIN-A
SpectraBase Compound ID 7NrffxujICc
InChI InChI=1S/C42H66O12/c1-22(2)13-17-30(43)24(5)16-20-33(45)42(10)21-11-12-29(42)26(7)31(44)18-15-25(6)32(19-14-23(3)4)53-40-38(50)36(48)39(28(9)52-40)54-41-37(49)35(47)34(46)27(8)51-41/h13-16,27-30,32,34-41,43,46-50H,7,11-12,17-21H2,1-6,8-10H3/b24-16+,25-15+/t27-,28-,29+,30?,32?,34-,35+,36-,37+,38-,39+,40+,41-,42+/m1/s1
InChIKey HEWSGOMXOQCVEP-QJIPHDQFSA-N
Mol Weight 763.0 g/mol
Molecular Formula C42H66O12
Exact Mass 762.455428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BjVFqEGVN9i
Name SECODEHYDRO-XESTOVANIN-A
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H66O12
InChI InChI=1S/C42H66O12/c1-22(2)13-17-30(43)24(5)16-20-33(45)42(10)21-11-12-29(42)26(7)31(44)18-15-25(6)32(19-14-23(3)4)53-40-38(50)36(48)39(28(9)52-40)54-41-37(49)35(47)34(46)27(8)51-41/h13-16,27-30,32,34-41,43,46-50H,7,11-12,17-21H2,1-6,8-10H3/b24-16+,25-15+/t27-,28-,29+,30?,32?,34-,35+,36-,37+,38-,39+,40+,41-,42+/m1/s1
InChIKey HEWSGOMXOQCVEP-QJIPHDQFSA-N
Literature Reference Author S.A.MORRIS,P.T.NORTHCOTE,R.J.ANDERSEN
Literature Reference Citation CAN.J.CHEM.,69,1352(1991)
Literature Reference DOI 10.1139/v91-201
Molecular Weight 762.979 g/mol
Solvent DMSO-D6
Source File Reference UWVP5528