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Methyl 16-(methoxycarbonyl)-androstane-14-oxo-18-isopimarate
SpectraBase Compound ID J9CzNPoubEs
InChI InChI=1S/C22H34O5/c1-20(13-17(23)26-4)12-9-15-14(18(20)24)7-8-16-21(15,2)10-6-11-22(16,3)19(25)27-5/h14-16H,6-13H2,1-5H3/t14-,15+,16?,20-,21-,22-/m1/s1
InChIKey XOLDXRGXVQPYGC-PGDLAMFKSA-N
Mol Weight 378.5 g/mol
Molecular Formula C22H34O5
Exact Mass 378.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwkJWcwlJoO
Name Methyl 16-(methoxycarbonyl)-androstane-14-oxo-18-isopimarate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O5
InChI InChI=1S/C22H34O5/c1-20(13-17(23)26-4)12-9-15-14(18(20)24)7-8-16-21(15,2)10-6-11-22(16,3)19(25)27-5/h14-16H,6-13H2,1-5H3/t14-,15+,16?,20-,21-,22-/m1/s1
InChIKey XOLDXRGXVQPYGC-PGDLAMFKSA-N
Molecular Weight 378.509 g/mol
SMILES [C@@]12(C([C@@](C(=O)OC)(C)CCC2)CC[C@]2(C(=O)[C@](CC[C@]12[H])(CC(=O)OC)C)[H])C
SPLASH splash10-00dj-0900000000-f0628cd4bde0803d3236
Source of Spectrum Y4-84-75-7
Wiley ID 1550055