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Substance Name: 18,21-Aldosterone diacetate 3-carboxymethyloxime
RN: 29415-05-2
InChIKey: HBWSKQPCLCKZPV-QSRVRQOKSA-N

Molecular Weight

  • 517.571
 
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Names and Synonyms

Name of Substance

  • 18,21-Aldosterone diacetate 3-carboxymethyloxime

Systematic Name

  • Pregn-4-ene-3,20-dione, 18,21-bis(acetyloxy)-11,18-epoxy-, 3-(O-(carboxymethyl)oxime), (11beta)-

Registry Numbers

CAS Registry Number

  • 29415-05-2

System Generated Number

  • 0029415052

Structure Descriptors

InChI

1S/C27H35NO9/c1-14(29)34-12-21(31)20-7-6-19-18-5-4-16-10-17(28-35-13-23(32)33)8-9-26(16,3)24(18)22-11-27(19,20)25(37-22)36-15(2)30/h10,18-20,22,24-25H,4-9,11-13H2,1-3H3,(H,32,33)/b28-17-/t18-,19-,20+,22-,24+,25?,26-,27?/m0/s1

InChIKey

HBWSKQPCLCKZPV-QSRVRQOKSA-N

Smiles

C1(\CC[C@@]2([C@H]3[C@@H]4C[C@@]5([C@H](CC[C@@H]5[C@@H]3CCC2=C1)C(COC(=O)C)=O)[C@@H](O4)OC(=O)C)C)=N\OCC(O)=O