基本信息 |
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产品名称: | 甘氨胆酸 |
CAS: | 64431-95-4 |
中文同义词: | 甘氨胆酸 |
英文同义词: | GLYCINE-1-13C, N-[(3A,5B,7A,12A)-3,7,12-TRIHYDROXY-24-OXOCHOLAN-24-YL]- ; GLYCOCHOLIC ACID-13C1 (GLYCYL-1-13C) ; GLYCOCHOLIC ACID-(GLYCYL-1-13C) |
MDL号: | MFCD00167403 |
氢键受体数量: | 7 |
氢键供体数量: | 5 |
Smile: | C[C@H](CCC(=O)NC[13C](=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C |
InChi: | InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1/i23+1 |
InChiKey: | InChIKey=RFDAIACWWDREDC-JSLOLQEMSA-N |
性质 |
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熔点: | 165-168 DEG C(LIT) |
注解: | MASS SHIFT: M+1 RIDADR: UN 3077 9/PG 3 WGK: 3 |
信息: | ISOTOPIC PURITY: 99 ATOM % 13C MW: 466.65 BY ATOM % CALCULATION |
安全信息 |
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危害码: | N |
风险声明: | R:51/53 |
安全声明: | S:61 |
WGK德国: | 3 |
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