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Bile acid

LIPID_IDBA0011

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

ACID

COMMON_NAHYOCHOLIC ACID

MOL_FORMULAC24H40O5

MOL_WT408

MELT_PT187-188¡¬C(031)

BOIL_PT

OPT_ROT[¦Á]27/D=+8¡¬ (031)

REFRA_IND

DENSITY

SOLUBILITY0.0045mM(WATER SOLUBILITY IN PROTONATED

FORM)(012)

UV_SPEC

IR_SPECcm-1 1718(C=0) 3430, 1050(OH) (012)

NMR_SPEC1H-NMR(CDCl3+10%DMSO-d6), 18-CH3=0.65(s),

19-CH3=0.90(s), 21-CH3=0.93(d,J= 5.4Hz),

3¦Â-H=3.39(brm), 6¦Â,7¦Â-H=3.82(m)

13C-NMR(CDCl3) Me ESTER,

C1=35.5,C2=30.4,C3=71.7,C4=32.6,C5=47.8,C6=71.9,

C7=69.6,C8=38.6,C9=32.5,C10=35.9,C14=58.5,C15=2

4.2,C16=27.4,C17

MS_SPECMe-TMS 548, 533, 458(BASE PEAK), 443, 405, 369,

253 (003)

NOTE_SPEC

SOURCE¥Ö¥¿ÃÀ½Á(097/098)¡¤´ÎÃÀÆ»¼À´µ´µ¼Ô¤ÎÇ¢(021/036/0

37/038/043/066)¤ª¤è¤Ó ·ìÞù (036/043)

BIOL_ACTIV

NOTE

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