CAS 641-81-6 MFCD00003622-APOCHOLIC ACID 辅胆酸 TAO{mole}

APOCHOLIC ACID 辅胆酸

CAS 641-81-6 MFCD00003622

化学结构图

SMILES: C[C@H](CCC(=O)O)[C@H]1CCC2=C3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C

化学属性

Mol. Formula	C₂₄H₃₈O₄
Mol. Weight	390.56
Melting Point	175-176 °C(lit.)

别名和识别编码

Chemical Name	APOCHOLIC ACID
MDL Number	MFCD00003622
CAS Number	641-81-6
Synonym	3α,12α-二羟基-5β-胆甾-8(14)烯-24-酸 5β,8(14)-胆烯-24-酸-3α,12α-二醇去水胆酸 3-alpha,12-alpha-Dihydroxy-5-beta-chol-8(14)-en-24-oic acid Apocholic Acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {hazard_com} Chol-8(14)-en-24-oic acid, 3,12-dihydroxy-, (3-alpha,5-beta,12-alpha)- {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {hazard_com} Apocholic acid
PubChem Substance ID	24855723
Wiswesser Line Notation	L E5 B666TJ A1 DQ E1 FY1&2VQ OQ
Beilstein Registry Number	3222755
LabNetwork Molecule ID	LN04687076
Chemical Name Translation	辅胆酸

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安全信息

WGK Germany3

Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 200 mg/kg/13W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   NATUAS Nature.  (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736)
   V.1-    1869-  Volume(issue)/page/year: 190,1007,1961

RTECSFZ5075000