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3H-Cyclopenta[5,6]naphth[2,1-c]oxepin, A-homo-4-oxaandrostan-3-one deriv.
SpectraBase Compound ID JIlT6U6Lekj
InChI InChI=1S/C23H34O6/c1-14(24)28-13-23-11-9-21(26)27-12-16(23)4-5-17-18-6-7-20(29-15(2)25)22(18,3)10-8-19(17)23/h16-20H,4-13H2,1-3H3/t16-,17+,18+,19+,20+,22+,23-/m1/s1
InChIKey MWICUNFLIRQWDM-VWIVDJIWSA-N
Mol Weight 406.5 g/mol
Molecular Formula C23H34O6
Exact Mass 406.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9p0Pi1fPPB
Name 3H-Cyclopenta[5,6]naphth[2,1-c]oxepin, A-homo-4-oxaandrostan-3-one deriv.
Alternate Name(s) A-Homo-4-oxaandrostan-3-one, 17,19-bis(acetyloxy)-, (5.beta.,17.beta.)- (5aS,5bS,7aS,8S,10aS,10bR,12aS)-5a-[(acetyloxy)methyl]-7a-methyl-3-oxohexadecahydro-1H-cyclopenta[5,6]naphtho[2,1-c]oxepin-8-yl acetate 4,17.beta.-diacetoxy-19-hydroxy-a-nor-3,4-seco-4.beta.-androstane-3-carboxylic acid 3,19-lactone
CAS Registry Number 124212-68-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O6
InChI InChI=1S/C23H34O6/c1-14(24)28-13-23-11-9-21(26)27-12-16(23)4-5-17-18-6-7-20(29-15(2)25)22(18,3)10-8-19(17)23/h16-20H,4-13H2,1-3H3/t16-,17+,18+,19+,20+,22+,23-/m1/s1
InChIKey MWICUNFLIRQWDM-VWIVDJIWSA-N
Molecular Weight 406.519 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(OC(=O)C)[H])[H])([H])CC[C@@]2(COC(CC1)=O)[H])[H])COC(=O)C
SPLASH splash10-000j-0091100000-dcdcdd75a5bd96d8acb4
Source of Spectrum KC-1989-1316-23
Wiley ID 1372210