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Bile acid

LIPID_IDBA0020

CHEM_NA3¦Â,7¦Á,12¦Â-TRIHYDROXY-5¦Â-CHOLAN-24-OIC

ACID

COMMON_NA

MOL_FORMULAC24H40O5

MOL_WT408

MELT_PT225-226¡¬C(102)

BOIL_PT

OPT_ROT[¦Á]/D=+23.4¡¬(EtOH)(102)

REFRA_IND

DENSITY

SOLUBILITY

UV_SPEC

IR_SPEC

NMR_SPEC1H-NMR(CD3COCD3-D2O)

(102),18-CH3=0.73(s),19-CH3=0.95(s),3¦Á-H=3.97(m)

,7¦Â-H=3.82(m),12¦Á-H=3.43(brm) 13C-NMR(CDCl3)

Me ESTER (060),

C1=29.8,C2=27.7,C3=66.6,C4=36.5,C5=35.7,C6=35.4,

C7=68.2,C8=38.0,C9=31.3,C10=34.4,C11=29.3,C12=7

9.0,C13=47.6,C14=48.6,C15

MS_SPECMe ESTER 422(M+), 420(M-2), 404(M-18) (102)

NOTE_SPEC

SOURCE

BIOL_ACTIV

NOTE

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