Bietaserpine

CAS 53-18-9 MFCD00242906

化学结构图

53-18-9
SMILES: CCN(CC)CCn1c2c(c3ccc(OC)cc31)CCN1C[C@H]3C[C@@H](OC(=O)c4cc(OC)c(OC)c(OC)c4)[C@H](OC)[C@@H](C(=O)OC)[C@H]3C[C@H]21

化学属性

Mol. FormulaC39H53N3O9
Mol. Weight707.95

别名和识别编码

Chemical Name3-beta,20-alpha-Yohimban-16-beta-carboxylic acid,1-(2-(diethylamino)ethyl)-18-beta-hydroxy-11,17-alpha-dimethoxy-, methyl ester,3,4,5-trimethoxybenzoate (ester)
Wiswesser Line NotationT F6 D5 C666 EN ON&&TTTJ E2N2&2 HO1 SOVR CO1 DO1 EO1&TO1 UVO1
Synonym 1-(2-(Diethylamino)ethyl)reserpine 1-diethylaminoethylreserpine Bietaserpine DL 152 DL-152 N-Diaethylaminoaethyl-reserpin Reserpine, 1-(2-(diethylamino)ethyl)- bietaserpine diethylaminoreserpine
CAS Number53-18-9
PubChem Substance ID20054848
InChIInChI=1S/C39H53N3O9/c1-9-40(10-2)15-16-42-29-20-25(45-3)11-12-26(29)27-13-14-41-22-24-19-33(37(49-7)34(39(44)50-8)28(24)21-30(41)35(27)42)51-38(43)23-17-31(46-4)36(48-6)32(18-23)47-5/h11-12,17-18,20,24,28,30,33-34,37H,9-10,13-16,19,21-22H2,1-8H3/t24-,28+,30-,33-,34+,37+/m1/s1
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安全信息

RTECSZF9380000 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 120 mg/kg
SEX/DURATION            : female 7-12 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   KSRNAM Kiso to Rinsho.  Clinical Report.  (Yubunsha Co., Ltd., 1-5, Kanda
   Suda-Cho, Chiyoda-ku, KS Bldg., Tokyo 101, Japan)  V.1-    1960-
   Volume(issue)/page/year: 4,2937,1970

系列性分类

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