53587-34-1 (4-羟基-3-甲氧基苦杏仁酸-D1氘代内标,(±)-4-Hydroxy-3-methoxymandelic-α-d1 Acid)

CAS号:
53587-34-1
中文名称:
4-羟基-3-甲氧基苦杏仁酸-D1氘代内标
英文名称:
(±)-4-Hydroxy-3-methoxymandelic-α-d1 Acid
分子式:
C9H10O5
分子量:
198.172703266144

4-羟基-3-甲氧基苦杏仁酸-D1氘代内标(53587-34-1)名称与标识符

名称

中文别名:
(±)-4-羟基-3-甲氧基扁桃酸-α-d1;4-羟基-3-甲氧基苦杏仁酸-D1;4-羟基-3-甲氧基苦杏仁酸-D1氘代内标;
英文别名:
dl-4-hydroxy-3-methoxymandelic-2-d1 acid;(±)-4-HYDROXY-3-METHOXYMANDELIC-2-D1 ACID;2-desoxoparaherquamide A;2-Deutero-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-essigsaeure;CHEMBL2103805;D09399;UNII-0L0UGK6OOX;H 0131;EN300-1868166;VMA;NCGC00093978-01;H-6500;NS00015078;S6613;NCGC00093978-03;NCGC00015492-05;STL558222;(+/-)-VANILMANDELIC ACID;SR-01000075241-1;Benzeneacetic acid, a,4-dihydroxy-3-methoxy-, (+/-)-;Vanillomandelic acid;SR-01000075241;HMS3371D20;Oprea1_553862;(+/-)-Vanillylmandelic acid;Benzeneacetic acid, a,4-dihydroxy-3-methoxy-, (A+/-)-;EINECS 200-224-0;MFCD00004235;DL-4-Hydroxy-3-methoxymandelic acid, analytical standard;Vanillylmandelic acid;2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid;dl-3-Methoxy-4-hydroxymandelic acid;Q901369;Benzeneacetic acid, alpha,4-dihydroxy-3-methoxy-;HMS3261J06;NCGC00015492-04;CHEBI:20106;Vanillinmandelic Acid;AKOS015851906;NCGC00015492-03;4'-Hydroxy-3'-methoxymandelic acid;SCHEMBL10085823;4-Hydroxy-3-methoxy-DL-mandelic acid;2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)acetic acid;NCGC00015492-02;(4-Hydroxy-3-methoxyphenyl)glycolic acid;Lopac0_000602;AS-62192;SCHEMBL134326;(?)-Vanillylmandelic acid;VANILMANDELIC ACID [MI];( inverted question mark)-4-Hydroxy-3-methoxymandelic acid;2-(4-Hydroxy-3-methoxyphenyl)-2-hydroxyacetic acid;Tox21_500602;53587-34-1;DL-vanillylmandelic acid;DL-4-Hydroxy-3-methoxymandelicacid;NCGC00015492-07;H0268;DB-349286;Hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid #;Mandelic acid, 4-hydroxy-3-methoxy-;Vanillylmandelic acid; VMA;NCGC00093978-02;4-Hydroxy-3-methoxy-DL-mandelic acid;dl-.alpha.,4-Dihydroxy-3-methoxyphenylacetic acid;A817001;Vanilmandelic acid;DCD57880-FBEE-4ED4-A834-92387D266E8A;CHEMBL1256396;HY-113121;LP00602;0DQI268449;EU-0100602;3-Methoxy-4-hydroxymandelate;2-(4'-Hydroxy-3'-methoxyphenyl) 2-hydroxyethanoic acid;CS-0059631;(.+/-.)-Vanilmandelic acid;(y)-Vanillylmandelic acid;( inverted question mark)-Vanillylmandelic acid;DL-vanillomandelic acid;4-HYDROXY-3-METHOXYMANDELIC ACID;Hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid;DB-071947;Vanillomandelc acid;FEMA NO. 4660;D90829;DL-4-Hydroxy-3-methoxymandelic acid, >=98% (TLC), powder;MLS002153465;55-10-7;(+/-)-3-METHOXY-4-HYDROXYMANDELIC ACID;C05584;CCG-204691;2394-20-9;BCP33203;DL-4-HYDROXY-3-METHOXYMANDELIC ACID (DL-VANILLYLMANDELIC ACID);3-methoxy-4-hydroxymandelic acid;Benzeneacetic acid, .alpha.,4-dihydroxy-3-methoxy-;GTPL6645;NCGC00261287-01;UNII-0DQI268449;SDCCGSBI-0050584.P002;HMS2235H06;3-Methoxy-4-hydroxyphenylhydroxyacetic acid;DTXSID10861583;4-hydroxy-3-methoxyphenylglycolic acid;SMR001230822;dl-4-Hydroxy-3-methoxymandelic acid;

标识符

InChIKey:
CGQCWMIAEPEHNQ-UHFFFAOYSA-N
Inchi:
1S/C9H10O5/c1-14-7-4-5(2-3-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)
SMILES:
O(C)C1=C(C=CC(=C1)C(C(=O)O)O)O

4-羟基-3-甲氧基苦杏仁酸-D1氘代内标(53587-34-1)物化性质

计算特性

  • 精确分子量 : 198.05282342g/mol
  • 氢键供体数量 : 3
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 3
  • 同位素质量 : 198.05282342g/mol
  • 重原子数量 : 14
  • 复杂度 : 205
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 1
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : -0.2
  • 拓扑分子极性表面积 : 87Ų

4-羟基-3-甲氧基苦杏仁酸-D1氘代内标(53587-34-1)推荐厂家 更多厂家(4)

公司名称手机号/电话联系人QQ微信询单
上海甄准生物科技有限公司 13816009161
021-68920155
姜经理13816009161 3001086693
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金锦乐(湖南)化学有限公司 金锦乐 1226360695
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上海赛可锐生物科技有限公司 13003271654
021-58000709
赛可锐生物 3004122151
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北京华威锐科化工有限公司 13269663372
010-89508211
李爽 2853391965
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