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POLASTEROL-A;3-BETA-HYDROXY-24-ISOPROPYLCHOLESTA-5,22(E)-DIEN-7-ONE
SpectraBase Compound ID 43OznRYYtdf
InChI InChI=1S/C30H48O2/c1-18(2)23(19(3)4)9-8-20(5)24-10-11-25-28-26(13-15-30(24,25)7)29(6)14-12-22(31)16-21(29)17-27(28)32/h8-9,17-20,22-26,28,31H,10-16H2,1-7H3/b9-8+/t20?,22-,24+,25?,26?,28?,29-,30+/m0/s1
InChIKey RZWRLBVGWQAKNS-ADHDTCFYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C30H48O2
Exact Mass 440.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G1XEhRmq0Vc
Name POLASTEROL-A;3-BETA-HYDROXY-24-ISOPROPYLCHOLESTA-5,22(E)-DIEN-7-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O2
InChI InChI=1S/C30H48O2/c1-18(2)23(19(3)4)9-8-20(5)24-10-11-25-28-26(13-15-30(24,25)7)29(6)14-12-22(31)16-21(29)17-27(28)32/h8-9,17-20,22-26,28,31H,10-16H2,1-7H3/b9-8+/t20?,22-,24+,25?,26?,28?,29-,30+/m0/s1
InChIKey RZWRLBVGWQAKNS-ADHDTCFYSA-N
Literature Reference Author A.UMEYAMA,K.ADACHI,S.ITO,S.ARIHARA
Literature Reference Citation J.NAT.PROD.,63,1175(2000)
Literature Reference DOI 10.1021/np000024j
Molecular Weight 440.710 g/mol
Solvent CDCl3
Source File Reference UWRU2118