[(1S,7S,8S,11R,12R,17R,19R)-7-(Furan-3-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadecan-19-yl] acetate

CAS 2629-11-0 MFCD02629110

化学结构图

2629-11-0
SMILES: CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)CC[C@@]2(C)[C@@H]2CC[C@]3(C)[C@H](c4ccoc4)OC(=O)[C@@H]4O[C@]43[C@@]21C

化学属性

Mol. Weight484.64
Mol. FormulaC28H36O7

别名和识别编码

Chemical NameGedunin
Chemicalbook IDCB02339397
Synonym Gedunin
CAS Number2629-11-0
InChIKeyROWFSYNHZPRCKO-QMBHMPINSA-N
PubChem Substance ID200744
InChIInChI=1S/C28H36O7/c1-15(29)33-20-13-18-24(2,3)19(30)8-10-25(18,4)17-7-11-26(5)21(16-9-12-32-14-16)34-23(31)22-28(26,35-22)27(17,20)6/h9,12,14,17-18,20-22H,7-8,10-11,13H2,1-6H3/t17-,18+,20-,21+,22?,25-,26+,27+,28?/m1/s1
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安全信息

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1040 mg/kg/65W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   BJCAAI British Journal of Cancer.  (Macmillan Press Ltd., Houndmills,
   Basingstoke, Hants. RG21 2XS, UK)  V.1-    1947-  Volume(issue)/page/year:
   20,134,1966

RTECSWH1428000

系列性分类

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