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10-ALPHA,13-ALPHA,16-ALPHA-TRIHYDROXY-9-METHYL-15-OXO-20-NOR-KAURAN-19-OIC_ACID_GAMMA-LACTONE_17-YL-16'-ALPHA,17'-DIHYDROXY-15'-OXO-ENT-KAUR-
SpectraBase Compound ID 1ufcbuiZ50e
InChI InChI=1S/C40H56O10/c1-31-11-5-12-32(2,24(31)9-15-35-19-23(7-8-25(31)35)38(47,21-41)27(35)42)29(44)49-22-39(48)28(43)36-16-10-26-33(3)13-6-14-40(26,50-30(33)45)34(36,4)17-18-37(39,46)20-36/h23-26,41,46-48H,5-22H2,1-4H3/t23?,24?,25?,26?,31?,32?,33-,34?,35?,36?,37?,38?,39?,40+/m0/s1
InChIKey JXEHRHFIBQTLLR-JLDGBPIJSA-N
Mol Weight 696.9 g/mol
Molecular Formula C40H56O10
Exact Mass 696.387348 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LN7ah1YNKt8
Name 10-ALPHA,13-ALPHA,16-ALPHA-TRIHYDROXY-9-METHYL-15-OXO-20-NOR-KAURAN-19-OIC_ACID_GAMMA-LACTONE_17-YL-16'-ALPHA,17'-DIHYDROXY-15'-OXO-ENT-KAUR-
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H56O10
InChI InChI=1S/C40H56O10/c1-31-11-5-12-32(2,24(31)9-15-35-19-23(7-8-25(31)35)38(47,21-41)27(35)42)29(44)49-22-39(48)28(43)36-16-10-26-33(3)13-6-14-40(26,50-30(33)45)34(36,4)17-18-37(39,46)20-36/h23-26,41,46-48H,5-22H2,1-4H3/t23?,24?,25?,26?,31?,32?,33-,34?,35?,36?,37?,38?,39?,40+/m0/s1
InChIKey JXEHRHFIBQTLLR-JLDGBPIJSA-N
Literature Reference Author A.BRACA,A.ARMENISE,I.MORELLI,J.MENDEZ,Q.MI,H.B.CHAI,S.M.SWAN SON,A.D.KINGHORN,N.D
Literature Reference Citation PLANTA.MED.,70,540(2004)
Literature Reference DOI 10.1055/s-2004-827155
Molecular Weight 696.879 g/mol
Solvent CD3OD
Source File Reference UWMZ48391