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Bile acid

LIPID_IDBA0152

CHEM_NA3¦Á,7¦Â-DIHYDROXY-6-OXO-5¦Â-CHOLAN-24-OIC

ACID

COMMON_NA

MOL_FORMULAC24H38O5

MOL_WT406

MELT_PT178-182¡¬C(Me ESTER)(197)

BOIL_PT

OPT_ROT[¦Á]20/D=-1.69¡¬(Me ESTER) (197)

REFRA_IND

DENSITY

SOLUBILITY

UV_SPEC

IR_SPECMe ESTER cm-1(CHCl3) 3606, 3458, 2951, 2870,

1730, 1705, 1460, 1095, 1050 (197)

NMR_SPECMe ESTER 1H-NMR(CDCl3);

0.66(s,18-Me),0.81(s,19-Me),0.93(d,J=5.9Hz,21-Me),

3.66(s,COOMe),4.04(d,J7¦Á,8¦Â=10.0Hz,7¦Á-H)

(197)13C-NMR(CDCl3); C3 69.9,C5 57.6,C6 213.9,C7

76.3,C24 174.8, CcooMe 51.6 (197)"

MS_SPECMe ESTER m/z(RELATIVE INTENSITY)

420(18%,M+),402(34%,M-18),305(14%,M-115),

287(50%,M-18-115),269(50%,M-(2x18+115))(197)

NOTE_SPEC

SOURCE²½³Ø¹çÀ®ÉÊ

BIOL_ACTIV

NOTE

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