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Bile acid

LIPID_IDBA0073

CHEM_NA3¦Â,4¦Â,12¦Á-TRIHYDROXY-5¦Â-CHOLAN-24-OIC

ACID

COMMON_NA

MOL_FORMULAC24H40O5

MOL_WT408

MELT_PT202-203¡¬C, 189-190¡¬C(Me ESTER)(151)

BOIL_PT

OPT_ROT

REFRA_IND

DENSITY

SOLUBILITY

UV_SPEC

IR_SPEC3412,1029cm-1(OH), 1705cm-1(C=O) (151)

NMR_SPEC1H-NMR(CDCl3+20%DMSO-d6):

0.66(s,18-Me),0.93(s,19-Me),0.97(d,J=6.3Hz,21-Me)3.

76(brm,4¦Á-H),3.90(m,3¦Á- AND 12¦Â-H)(151)

13C-NMR Me ESTER: C1 29.1,C2 25.7,C3 68.3,C4

69.5,C5 43.9,C6 20.6,C7 25.7, C8 35.7,C9 34.9,C10

36.1,C11 28.9,C12 73.1,C13 46.4,C14 C23 30.9,C24

174.6,CCOOMe 51.4(151)

MS_SPECMe ESTER M/Z(RELATIVE INTENSITY,%)

404(4%),289(100%),271(23%),253(13%) (151)

NOTE_SPEC

SOURCE

BIOL_ACTIV

NOTE

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