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3-ALPHA-ACETOXY-27-HYDROXYLUP-20-(29)-EN-24-OIC_ACID
SpectraBase Compound ID 2Qx4jYA8PW7
InChI InChI=1S/C32H50O5/c1-19(2)21-10-13-28(4)16-17-32(18-33)22(26(21)28)8-9-23-29(5)14-12-25(37-20(3)34)31(7,27(35)36)24(29)11-15-30(23,32)6/h21-26,33H,1,8-18H2,2-7H3,(H,35,36)/t21-,22+,23+,24+,25+,26+,28+,29+,30+,31+,32-/m0/s1
InChIKey SFMBHTKBXIQXHJ-LBIUZANVSA-N
Mol Weight 514.7 g/mol
Molecular Formula C32H50O5
Exact Mass 514.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AcvLOXY4boz
Name 3-ALPHA-ACETOXY-27-HYDROXYLUP-20-(29)-EN-24-OIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H50O5
InChI InChI=1S/C32H50O5/c1-19(2)21-10-13-28(4)16-17-32(18-33)22(26(21)28)8-9-23-29(5)14-12-25(37-20(3)34)31(7,27(35)36)24(29)11-15-30(23,32)6/h21-26,33H,1,8-18H2,2-7H3,(H,35,36)/t21-,22+,23+,24+,25+,26+,28+,29+,30+,31+,32-/m0/s1
InChIKey SFMBHTKBXIQXHJ-LBIUZANVSA-N
Literature Reference Author A.U.RAHMAN,H.NAZ,X.FADIMATOU,T.MAKHMOOR,A.YASIN,N.FATIMA,F.N .NGOUNOU,S.F.KIMBU,B
Literature Reference Citation J.NAT.PROD.,68,189(2005)
Literature Reference DOI 10.1021/np040142x
Molecular Weight 514.746 g/mol
Solvent CD3OD
Source File Reference UWMZ8869