CAS 1449-05-4 MFCD00064897-18α-Glycyrrhetinic Acid 18α-甘草次酸 TAO{mole}

18α-Glycyrrhetinic Acid 18α-甘草次酸

CAS 1449-05-4 MFCD00064897

化学结构图

SMILES: CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@H]3C[C@@](C)(C(=O)O)CC[C@]3(C)CC[C@]21C

化学属性

Mol. Formula	C30 H46 O4
Mol. Weight	470.68
Density	1.14
Melting Point	>274ºC (dec.)
Boiling Point
Flash Point	-

别名和识别编码

Chemical Name	18α-Glycyrrhetinic Acid
MDL Number	-
CAS Number	1449-05-4
EC Number	215-907-9
Synonym	(18α)-3β-Hydroxy-11-oxoolean-12-en-30-oic acid 18-ALFA-甘草次酸 18-ALPHA-GLYCYRRHETICACID 18-Isoglycyrrhetinic acid, (3,18a,20)-3-Hydroxy-11-oxo-olean-12-en-29-oic acid 18A-GLYCYRRHETINIC ACID 18A-甘草次酸 18ALPHA-GLYCYRRHETINIC ACID 18Alpha-Glycyrrhetinic Acid {LY} 18a-Glycyrrhetinic Acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 18a-Glycyrrhetinic Acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID	73398
Chemical Name Translation	18α-甘草次酸
InChIKey	MPDGHEJMBKOTSU-PMTKVOBESA-N
Wiswesser Line Notation	L F6 E6 B666 CV DUTJ A1 HVQ H1 K1 N1 O1 S1 S1 TQ-BETA
Beilstein Registry Number	2956366
LabNetwork Molecule ID	LN01293700
InChI	InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21+,22+,23-,26-,27+,28+,29-,30-/m1/s1
Canonical SMILES	-

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安全信息

Hazard Codes Xn

Safety Statements

Risk Statements

R22 Harmful if swallowed 吞咽有害

WGK Germany3

GHS Symbol

Hazard statements

H302 Harmful if swallowed 吞食有害

RTECSRK0190000

Signal word

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 560 mg/kg
TOXIC EFFECTS :
   Behavioral - changes in motor activity (specific assay)
   Gastrointestinal - other changes
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 28,3449,1980

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 455 mg/kg
TOXIC EFFECTS :
   Behavioral - changes in motor activity (specific assay)
   Gastrointestinal - other changes
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 28,3449,1980

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#02068

Precautionary statements

P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
P301+P312
P330 Rinse mouth. 漱口
P501 Dispose of contents/container to..… 处理内容物/容器.....

Storage condition -20 -20°C -20℃

其他信息

MOL 文件:1449-05-4.mol