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2-Propen-1-one, 1-[(3.beta.,5.beta.,17.beta.)-3-(acetyloxy)androstan-17-yl]-3-phenyl-
SpectraBase Compound ID HRmz0bZ3P71
InChI InChI=1S/C30H40O3/c1-20(31)33-23-15-17-29(2)22(19-23)10-11-24-25-12-13-27(30(25,3)18-16-26(24)29)28(32)14-9-21-7-5-4-6-8-21/h4-9,14,22-27H,10-13,15-19H2,1-3H3/b14-9-/t22-,23+,24?,25?,26?,27-,29+,30+/m1/s1
InChIKey SWTNFHMWIPZFLE-UXECWHTMSA-N
Mol Weight 448.6 g/mol
Molecular Formula C30H40O3
Exact Mass 448.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLlTYK5cQ0R
Name 2-Propen-1-one, 1-[(3.beta.,5.beta.,17.beta.)-3-(acetyloxy)androstan-17-yl]-3-phenyl-
CAS Registry Number 74464-42-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40O3
InChI InChI=1S/C30H40O3/c1-20(31)33-23-15-17-29(2)22(19-23)10-11-24-25-12-13-27(30(25,3)18-16-26(24)29)28(32)14-9-21-7-5-4-6-8-21/h4-9,14,22-27H,10-13,15-19H2,1-3H3/b14-9-/t22-,23+,24?,25?,26?,27-,29+,30+/m1/s1
InChIKey SWTNFHMWIPZFLE-UXECWHTMSA-N
Molecular Weight 448.647 g/mol
SMILES [C@@]12(C(C3CC[C@]4([C@@](C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)[H])CC[C@@]1(C(\C=C/c1ccccc1)=O)[H])C
SPLASH splash10-001i-5921000000-1f7c4751e6aad4a285a0
Source of Spectrum HE-1982-0-0
Synonyms (2S,5S,7R,14S,15S)-2,15-dimethyl-14-[(2Z)-3-phenylprop-2-enoyl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-yl acetate 5.beta.-pregnanon(20), 3.beta.-acetoxy-21-benzyliden-
Wiley ID 60627