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Bile acid

LIPID_IDBA0010

CHEM_NA3,12-DIOXO-5¦Â-CHOLAN-24-OIC ACID

COMMON_NADEHYDRODEOXYCHOLIC ACID

MOL_FORMULAC24H36O4

MOL_WT388

MELT_PT187¡¬C, 129-130¡¬C(Me ESTER)(052)

BOIL_PT

OPT_ROT[¦Á]/D=+92¡¬ (052)

REFRA_IND

DENSITY

SOLUBILITY

UV_SPEC

IR_SPEC

NMR_SPEC1H-NMR (CDCl3) COOMe (089), 18-CH3=1.07(s),

19-CH3=1.12(s)13C-NMR(CDCl3) Me ESTER (030),

C1=36.8,C2=36.8,C3=211.6,C4=42.0,C5=43.7,

C6=25.5,C7=26.6,C8=35.4,C9=44.3,C10=35.6,C11=38

.3,C12=213.7,C13=57.5,C14=58.5,C15=24.2,C16=27.4

,C17=46.5,C18=11.7

MS_SPECMe-TMS 402, 384, 329, 269, 247(BASE PEAK), 229

(003)

NOTE_SPEC

SOURCE¥Ò¥ÈÊµÊØ(015/018)

BIOL_ACTIV

NOTE

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