| Bile acid |
| LIPID_ID | BA0013 |
| CHEM_NA | 3¦Á,6¦Â,7¦Â-TRIHYDROXY-5¦Â-CHOLAN-24-OIC |
| ACID |
| COMMON_NA | ¦Â-MURICHOLIC ACID |
| MOL_FORMULA | C24H40O5 |
| MOL_WT | 408 |
| MELT_PT | 225-226¡¬C(031) |
| BOIL_PT |
| OPT_ROT | [¦Á]/D=+62¡¬ (031) |
| REFRA_IND |
| DENSITY |
| SOLUBILITY |
| UV_SPEC |
| IR_SPEC | cm-1 1695 (C=0) 3425, 1052 (OH) (096) |
| NMR_SPEC | 1H-NMR(CDCl3+20%DMSO-d6), 18-CH3=0.68(s), |
| 19-CH3=1.08(s), 21-CH3=0.94(d,J= 6.3Hz), |
| 3¦Â,7¦Á-H=3.50(brm),6¦Á-H=3.61(m) |
| 13C-NMR(CDCl3) Me ESTER, |
| C1=35.4,C2=29.9,C3=70.9,C4=35.4,C5=47.2,C6=75.4, |
| C7=73.5,C8=38.5,C9=39.6,C10=33.8,C11=20.8,C12=3 |
| 9.9,C13=43.7,C14= |
| MS_SPEC | Me-TMS 548, 533, 458, 369, 351, 285, 253, |
| 195(BASE PEAK) (003) |
| NOTE_SPEC |
| SOURCE | ¥Þ¥¦¥¹¡¤¥é¥Ã¥ÈÃÀ½Á(100)¡¤²«áÕ¥é¥Ã¥È¤ÎÇ¢(101) |
| BIOL_ACTIV |
| NOTE |
| 1998ǯ10·î26Æü | 13 / 591 ¥Ú¡¼¥¸ |