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(24R)-3.beta.-Acetoxy-24-methyl-5.alpha.-cholest-20(22)-en-6,23-dione
SpectraBase Compound ID I6cDVyfGYTG
InChI InChI=1S/C30H46O4/c1-17(2)19(4)27(32)14-18(3)23-8-9-24-22-16-28(33)26-15-21(34-20(5)31)10-12-30(26,7)25(22)11-13-29(23,24)6/h14,17,19,21-26H,8-13,15-16H2,1-7H3/b18-14-/t19-,21+,22+,23-,24+,25+,26-,29-,30-/m1/s1
InChIKey SNNGOSKDHLQAAE-HNSMIROLSA-N
Mol Weight 470.7 g/mol
Molecular Formula C30H46O4
Exact Mass 470.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GabEEquBFo0
Name (24R)-3.beta.-Acetoxy-24-methyl-5.alpha.-cholest-20(22)-en-6,23-dione
Alternate Name(s) (3beta,5alpha,20Z)-6,23-dioxoergost-20(22)-en-3-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H46O4
InChI InChI=1S/C30H46O4/c1-17(2)19(4)27(32)14-18(3)23-8-9-24-22-16-28(33)26-15-21(34-20(5)31)10-12-30(26,7)25(22)11-13-29(23,24)6/h14,17,19,21-26H,8-13,15-16H2,1-7H3/b18-14-/t19-,21+,22+,23-,24+,25+,26-,29-,30-/m1/s1
InChIKey SNNGOSKDHLQAAE-HNSMIROLSA-N
Molecular Weight 470.694 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(\C(=C/C([C@@](C(C)C)(C)[H])=O)C)[H])[H])([H])CC([C@]2(C[C@@](OC(=O)C)(CC1)[H])[H])=O)[H])C
SPLASH splash10-0002-0009500000-e5c5a2bdc22c7442a650
Source of Spectrum F-53-17052-17
Wiley ID 804719