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3b-Acetoxy-12b-(3,4-dimethyl-2-pentenoyloxy)-8,14-dihydroxy-14b,17a-pregn-5-en-20-one
SpectraBase Compound ID 6rbTN7dKLp9
InChI InChI=1S/C30H44O7/c1-17(2)18(3)14-26(33)37-25-16-24-27(6)11-9-22(36-20(5)32)15-21(27)8-12-29(24,34)30(35)13-10-23(19(4)31)28(25,30)7/h8,14,17,22-25,34-35H,9-13,15-16H2,1-7H3/b18-14+
InChIKey XAAOUBXVYGYOBY-NBVRZTHBSA-N
Mol Weight 516.7 g/mol
Molecular Formula C30H44O7
Exact Mass 516.308704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8k6nmchcdBQ
Name 3b-Acetoxy-12b-(3,4-dimethyl-2-pentenoyloxy)-8,14-dihydroxy-14b,17a-pregn-5-en-20-one
CAS Registry Number 51267-31-3
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C30H44O7
InChI InChI=1S/C30H44O7/c1-17(2)18(3)14-26(33)37-25-16-24-27(6)11-9-22(36-20(5)32)15-21(27)8-12-29(24,34)30(35)13-10-23(19(4)31)28(25,30)7/h8,14,17,22-25,34-35H,9-13,15-16H2,1-7H3/b18-14+
InChIKey XAAOUBXVYGYOBY-NBVRZTHBSA-N
Literature Reference J.W. Blunt, J.B. Stothers, Org. Magn. Resonance 9, 439 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3