Strychnine sulfate pentahydrate

CAS
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CAS
60491-10-3
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Purity
99%+
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Catalog Number

ACM60491103

Product Name

Strychnine sulfate pentahydrate

Structure

CAS

60491-10-3

Category

Heterocyclic Organic Compound

Molecular Weight

857

Molecular Formula

C₄₂H₅₆N₄O₁₃S

InChI

InChI=1S/2C21H22N2O2.H₂O4S.5H₂O/c2*24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21;1-5(2,3)4;/h2*1-5,13,16-17,19-20H,6-11H2;(H2,1,2,3,4);5*1H2/t2*13-,16-,17-,19-,20-,21+;/m0./s1

InChI Key

FDQUTDUZMOOVST-ZKOSLKCXSA-N

Complexity

771

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Exact Mass

856.35645903

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isomeric SMILES

C1CN2CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.C1CN2CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.O.O.O.O.O.OS(=O)(=O)O

Monoisotopic Mass

856.35645903

Physical State

Solid

Rotatable Bond Count

Topological Polar Surface Area

154 Å²

MSDS

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COA

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Spec Sheet