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SCHLEICHERASTATIN-7;24-ALPHA-METHYL-3-BETA,22-ALPHA-DIHYDROXY-7-OXO-CHOLEST-5-ENE
SpectraBase Compound ID 82yJZN1Z4HQ
InChI InChI=1S/C28H46O3/c1-16(2)17(3)13-24(30)18(4)21-7-8-22-26-23(10-12-28(21,22)6)27(5)11-9-20(29)14-19(27)15-25(26)31/h15-18,20-24,26,29-30H,7-14H2,1-6H3/t17-,18+,20+,21-,22+,23+,24+,26+,27+,28-/m1/s1
InChIKey PKESXWKAOMUZDM-UCENTVSCSA-N
Mol Weight 430.7 g/mol
Molecular Formula C28H46O3
Exact Mass 430.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 21EOYei2NMu
Name SCHLEICHERASTATIN-7;24-ALPHA-METHYL-3-BETA,22-ALPHA-DIHYDROXY-7-OXO-CHOLEST-5-ENE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H46O3
InChI InChI=1S/C28H46O3/c1-16(2)17(3)13-24(30)18(4)21-7-8-22-26-23(10-12-28(21,22)6)27(5)11-9-20(29)14-19(27)15-25(26)31/h15-18,20-24,26,29-30H,7-14H2,1-6H3/t17-,18+,20+,21-,22+,23+,24+,26+,27+,28-/m1/s1
InChIKey PKESXWKAOMUZDM-UCENTVSCSA-N
Literature Reference Author G.R.PETTIT,A.NUMATA,G.M.CRAGG,D.L.HERALD,T.TAKADA,C.IWAMOTO, R.RIESEN,J.M.SCHMIDT
Literature Reference Citation J.NAT.PROD.,63,72(2000)
Literature Reference DOI 10.1021/np990346r
Molecular Weight 430.671 g/mol
Solvent Unknown
Source File Reference UWRU1703