硫胺焦磷酸盐 thiamine pyrophosphate chloride 154-87-0

硫胺焦磷酸盐 thiamine pyrophosphate chloride

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iupac名称 IUPAC Name :2- [3-[（4-氨基-2-甲基嘧啶-5-基）甲基] -4-甲基-1 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate chloride

INCHI InChI :INCHI InChI=1/C12H18N4O7P2S.ClH/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13;/h5,7H,3-4,6h2 6H2,1-2 3 1-2H3,(H4-,13,14,15,17,18,19,20,21);1H

印地 Std.InChI: INCHI InChI=1S/C12H18N4O7P2S.ClH/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13;/h5,7H,3-4,6h2 6H2,1-2 3 1-2H3,(H4-,13,14,15,17,18,19,20,21);1H

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INCHI基 InChIKey :YXVCLPJQTZXJLH-UHFFFAOYAW

标准奇奇 Std.InChIKey: YXVCLPJQTZXJLH-UHFFFAOYSA-N

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微笑 SMILES :CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)ccop CCop OP(= o =O)(O)op OP(= o =O)(O)O.[cl- Cl-]

MDL : mfcd00038740 MFCD00038740