3-[3'-Methoxy-1',3',5'(10'),16-estratetraen-17'-yl]-5,5-dimethylfuran-2(5H)-one

SpectraBase Compound ID	KIr9611nS9h
InChI	InChI=1S/C25H30O3/c1-24(2)22(14-23(26)28-24)21-10-9-20-19-7-5-15-13-16(27-4)6-8-17(15)18(19)11-12-25(20,21)3/h6,8,10,13-14,18-20H,5,7,9,11-12H2,1-4H3/t18?,19?,20?,25-/m0/s1
InChIKey	QXSFWINUXOGELR-RPMAUJEDSA-N Google Search
Mol Weight	378.51 g/mol
Molecular Formula	C25H30O3
Exact Mass	378.219495 g/mol

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SpectraBase Spectrum ID	AzjQ9D1fjWa
Name	3-[3'-Methoxy-1',3',5'(10'),16-estratetraen-17'-yl]-5,5-dimethylfuran-2(5H)-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H30O3
InChI	InChI=1S/C25H30O3/c1-24(2)22(14-23(26)28-24)21-10-9-20-19-7-5-15-13-16(27-4)6-8-17(15)18(19)11-12-25(20,21)3/h6,8,10,13-14,18-20H,5,7,9,11-12H2,1-4H3/t18?,19?,20?,25-/m0/s1
InChIKey	QXSFWINUXOGELR-RPMAUJEDSA-N
Molecular Weight	378.512 g/mol
SMILES	C=1([C@@]2(C(C3CCc4c(C3CC2)ccc(OC)c4)CC1)C)C=1C(OC(C1)=O)(C)C
SPLASH	splash10-004i-0319000000-6340d1c2eb401d500775
Source of Spectrum	U1-1999-3312-11
Synonyms	3-[3-methoxyestra-1,3,5(10),16-tetraen-17-yl]-5,5-dimethyl-2(5H)-furanone 4-[3'-Methoxy-1',3',5'(10'),16-estratetraen-17'-yl]-5,5-dimethylfuran-2(5H)-one
Wiley ID	753521