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Substance Name: Pregnane-3,6,17-triol triacetate
RN: 113846-07-4
InChIKey: CTHSOFYMWQMUQJ-KLZDTNLLSA-N

Molecular Weight

  • 476.606
 
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Names and Synonyms

Name of Substance

  • Pregnane-3,6,17-triol triacetate

Synonyms

  • 5beta-Pregnane-3alpha,6alpha,17alpha-triol triacetate
  • Pgtriol triacetate

Registry Numbers

CAS Registry Number

  • 113846-07-4

System Generated Number

  • 0113846074

Structure Descriptors

InChI

1S/C27H40O7/c1-15(28)27(34-18(4)31)12-9-22-20-14-24(33-17(3)30)23-13-19(32-16(2)29)7-10-25(23,5)21(20)8-11-26(22,27)6/h19-24H,7-14H2,1-6H3/t19-,20+,21-,22-,23-,24-,25+,26-,27-/m0/s1

InChIKey

CTHSOFYMWQMUQJ-KLZDTNLLSA-N

Smiles

CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@H]4[C@@]3(CC[C@@H](C4)OC(=O)C)C)OC(=O)C)C)OC(=O)C