Product Information
Chemical Data
Analyte Name
Aldosterone CMO biotin
Molecular Formula
C36 H53 N5 O8 S
Molecular Weight
715.9
Accurate Mass
715.361
SMILES
C[C@]12CC\C(=N/OCC(=O)NCCCNC(=O)CCCCC3SC[C@@H]4NC(=O)N[C@H]34)\C=C1CCC5C6CCC(C(=O)CO)[C@@]67C[C@H](O[C@@H]7O)C25
InChI
InChI=1S/C36H53N5O8S/c1-35-12-11-21(15-20(35)7-8-22-23-9-10-24(26(43)17-42)36(23)16-27(31(22)35)49-33(36)46)41-48-18-30(45)38-14-4-13-37-29(44)6-3-2-5-28-32-25(19-50-28)39-34(47)40-32/h15,22-25,27-28,31-33,42,46H,2-14,16-19H2,1H3,(H,37,44)(H,38,45)(H2,39,40,47)/b41-21+/t22?,23?,24?,25-,27-,28?,31?,32-,33-,35-,36+/m0/s1
IUPAC
5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[3-[[2-[(E)-[(1R,14R,16S,18S)-18-hydroxy-2-(2-hydroxyacetyl)-14-methyl-17-oxapentacyclo[14.2.1.01,5.06,15.09,14]nonadec-9-en-11-ylidene]amino]oxyacetyl]amino]propyl]pentanamide
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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