9-[(7R,8R,9S,13S,14S,16S)-3,16-diacetoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-7-yl]nonyl acetate

SpectraBase Compound ID	2gDNGVFqNc5
InChI	InChI=1S/C33H46O7/c1-21(34)38-17-11-9-7-5-6-8-10-12-24-18-25-19-26(39-22(2)35)13-14-27(25)28-15-16-33(4)29(31(24)28)20-30(32(33)37)40-23(3)36/h13-14,19,24,28-31H,5-12,15-18,20H2,1-4H3/t24-,28-,29+,30+,31-,33+/m1/s1
InChIKey	NRYXKBKQGIJSCF-ULUJAITOSA-N Google Search
Mol Weight	554.7 g/mol
Molecular Formula	C33H46O7
Exact Mass	554.324354 g/mol

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SpectraBase Spectrum ID	IYGTGXWmak6
Name	9-[(7R,8R,9S,13S,14S,16S)-3,16-diacetoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-7-yl]nonyl acetate
Alternate Name(s)	9-[(7R,8R,9S,13S,14S,16S)-3,16-diacetyloxy-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-7-yl]nonyl ethanoate 9-[(7R,8R,9S,13S,14S,16S)-3,16-diacetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-7-yl]nonyl acetate Acetic acid 9-[(7R,8R,9S,13S,14S,16S)-3,16-diacetoxy-17-keto-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-7-yl]nonyl ester Acetic acid 9-[(7R,8R,9S,13S,14S,16S)-3,16-diacetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-7-yl]nonyl ester
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Formula	C33H46O7
InChI	InChI=1S/C33H46O7/c1-21(34)38-17-11-9-7-5-6-8-10-12-24-18-25-19-26(39-22(2)35)13-14-27(25)28-15-16-33(4)29(31(24)28)20-30(32(33)37)40-23(3)36/h13-14,19,24,28-31H,5-12,15-18,20H2,1-4H3/t24-,28-,29+,30+,31-,33+/m1/s1
InChIKey	NRYXKBKQGIJSCF-ULUJAITOSA-N
Molecular Weight	554.724 g/mol
SMILES	c1(ccc2c(c1)C[C@]([C@]1([C@@]3(C[C@@](C([C@@]3(C)CC[C@]21[H])=O)(OC(=O)C)[H])[H])[H])(CCCCCCCCCOC(=O)C)[H])OC(=O)C
SPLASH	splash10-0udi-0000900000-0dda5ee0da569c9d2f16
Source of Spectrum	K-2002-2277-8
Wiley ID	1613071