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2-ALPHA,3-ALPHA-DIHYDROXY-11-ALPHA-METHOXY-URS-12-EN-28-OIC-ACID;GYMNANTHERARIC-ACID
SpectraBase Compound ID 44I77QzksUx
InChI InChI=1S/C31H50O5/c1-17-9-12-31(26(34)35)14-13-29(6)19(23(31)18(17)2)15-21(36-8)24-28(5)16-20(32)25(33)27(3,4)22(28)10-11-30(24,29)7/h15,17-18,20-25,32-33H,9-14,16H2,1-8H3,(H,34,35)/t17-,18+,20-,21-,22?,23+,24?,25-,28+,29-,30-,31+/m1/s1
InChIKey GNBLDTSHJKVAEE-YJIONLGUSA-N
Mol Weight 502.7 g/mol
Molecular Formula C31H50O5
Exact Mass 502.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 789k4UD0uiy
Name 2-ALPHA,3-ALPHA-DIHYDROXY-11-ALPHA-METHOXY-URS-12-EN-28-OIC-ACID;GYMNANTHERARIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O5
InChI InChI=1S/C31H50O5/c1-17-9-12-31(26(34)35)14-13-29(6)19(23(31)18(17)2)15-21(36-8)24-28(5)16-20(32)25(33)27(3,4)22(28)10-11-30(24,29)7/h15,17-18,20-25,32-33H,9-14,16H2,1-8H3,(H,34,35)/t17-,18+,20-,21-,22?,23+,24?,25-,28+,29-,30-,31+/m1/s1
InChIKey GNBLDTSHJKVAEE-YJIONLGUSA-N
Literature Reference Author A.IKUTA,H.TOMIYASU,Y.MORITA,K.YOSHIMURA
Literature Reference Citation J.NAT.PROD.,66,1051(2003)
Literature Reference DOI 10.1021/np030069v
Molecular Weight 502.735 g/mol
Solvent C5D5N
Source File Reference UWSP141