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3.beta.,21.alpha.-Diacetoxy-26-nor-8,14-seco-gamma-ser-14(27)-en-8-one
SpectraBase Compound ID 3psJNIiQSCs
InChI InChI=1S/C33H52O5/c1-20-10-14-26-30(4,5)28(37-21(2)34)16-18-32(26,8)23(20)11-12-24-25(36)13-15-27-31(6,7)29(38-22(3)35)17-19-33(24,27)9/h23-24,26-29H,1,10-19H2,2-9H3/t23-,24?,26?,27?,28-,29-,32+,33?/m0/s1
InChIKey KZDLZUALEIEHHU-LEQLEADYSA-N
Mol Weight 528.8 g/mol
Molecular Formula C33H52O5
Exact Mass 528.381475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5AUrqhR2Pw
Name 3.beta.,21.alpha.-Diacetoxy-26-nor-8,14-seco-gamma-ser-14(27)-en-8-one
Alternate Name(s) (2S)-5-{2-[(6S)-6-(acetyloxy)-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl]ethyl}-1,1,4a-trimethyl-6-oxodecahydro-2-naphthalenyl acetate 3.beta.,21.alpha.-Diacetoxy-26-nor-8,14-seco-gamma-ser-14(270-en-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H52O5
InChI InChI=1S/C33H52O5/c1-20-10-14-26-30(4,5)28(37-21(2)34)16-18-32(26,8)23(20)11-12-24-25(36)13-15-27-31(6,7)29(38-22(3)35)17-19-33(24,27)9/h23-24,26-29H,1,10-19H2,2-9H3/t23-,24?,26?,27?,28-,29-,32+,33?/m0/s1
InChIKey KZDLZUALEIEHHU-LEQLEADYSA-N
Molecular Weight 528.774 g/mol
SMILES [C@@]12(C(C(C)(C)[C@](CC2)(OC(=O)C)[H])CCC([C@@]1(CCC1C2(C(C(C)(C)[C@](CC2)(OC(=O)C)[H])CCC1=O)C)[H])=C)C
SPLASH splash10-000f-9500120000-b925683cab12eef1efe4
Source of Spectrum QF-45-962-1
Wiley ID 833419