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(R)-3,4,5,6,7,8,9,10-Octahydro-12-benzyloxy-14-methoxy-3-methyl-5,5-(prop-1,3-yledithio)-1H-benzoxacyclododecin-1-one
SpectraBase Compound ID KQNvw6gSFGx
InChI InChI=1S/C27H34O4S2/c1-20-18-27(32-14-9-15-33-27)13-8-4-7-12-22-16-23(30-19-21-10-5-3-6-11-21)17-24(29-2)25(22)26(28)31-20/h3,5-6,10-11,16-17,20H,4,7-9,12-15,18-19H2,1-2H3/t20-/m1/s1
InChIKey GUHHCIJJMDNSDH-HXUWFJFHSA-N
Mol Weight 486.7 g/mol
Molecular Formula C27H34O4S2
Exact Mass 486.189852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AKwTncoF4k
Name (R)-3,4,5,6,7,8,9,10-Octahydro-12-benzyloxy-14-methoxy-3-methyl-5,5-(prop-1,3-yledithio)-1H-benzoxacyclododecin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O4S2
InChI InChI=1S/C27H34O4S2/c1-20-18-27(32-14-9-15-33-27)13-8-4-7-12-22-16-23(30-19-21-10-5-3-6-11-21)17-24(29-2)25(22)26(28)31-20/h3,5-6,10-11,16-17,20H,4,7-9,12-15,18-19H2,1-2H3/t20-/m1/s1
InChIKey GUHHCIJJMDNSDH-HXUWFJFHSA-N
Molecular Weight 486.685 g/mol
SMILES C1(c2c(cc(cc2CCCCCC2(C[C@](O1)(C)[H])SCCCS2)OCc1ccccc1)OC)=O
SPLASH splash10-0006-9002100000-d512fadab15b79eba365
Source of Spectrum KC-0-2620-11
Synonyms (3R)-12-(benzyloxy)-14-methoxy-3-methyl-1,3,4,6,7,8,9,10-octahydrospiro[2-benzoxacyclododecine-5,2'-[1,3]dithiane]-1-one (9'R)-13'-methoxy-9'-methyl-15'-phenylmethoxy-11'-spiro[1,3-dithiane-2,7'-10-oxabicyclo[10.4.0]hexadeca-1(16),12,14-triene]one (9'R)-13'-methoxy-9'-methyl-15'-phenylmethoxyspiro[1,3-dithiane-2,7'-10-oxabicyclo[10.4.0]hexadeca-1(16),12,14-triene]-11'-one (9'R)-15'-benzyloxy-13'-methoxy-9'-methyl-spiro[1,3-dithiane-2,7'-10-oxabicyclo[10.4.0]hexadeca-1(16),12,14-triene]-11'-one (9'R)-13'-methoxy-9'-methyl-15'-phenylmethoxy-spiro[1,3-dithiane-2,7'-10-oxabicyclo[10.4.0]hexadeca-1(16),12,14-triene]-11'-one
Wiley ID 786709