Uscharin

CAS Registry Number®

24211-81-2
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CAS Name

Uscharin

Molecular Formula

C31H41NO8S

Molecular Mass

587.72

Cite this Page

Uscharin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=24211-81-2 (retrieved 2024-05-18) (CAS RN: 24211-81-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    265 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C31H41NO8S/c1-17-13-30(32-9-10-41-30)31(36)26(38-17)39-23-12-19-3-4-22-21(28(19,16-33)14-24(23)40-31)5-7-27(2)20(6-8-29(22,27)35)18-11-25(34)37-15-18/h9,11,16-17,19-24,26,35-36H,3-8,10,12-15H2,1-2H3/t17-,19+,20-,21+,22-,23-,24-,26+,27-,28-,29+,30+,31-/m1/s1

InChIKey

InChIKey=DONIPVCAKBPJLH-IGACXKNBSA-N

SMILES

C(=O)[C@@]12[C@@]3([C@]([C@]4(O)[C@](C)(CC3)[C@H](CC4)C5=CC(=O)OC5)(CC[C@]1(C[C@@]6([C@@](C2)(O[C@]7(O)[C@](O6)(O[C@H](C)C[C@@]78N=CCS8)[H])[H])[H])[H])[H])[H]

Canonical SMILES

O=CC12CC3OC4(O)C(OC(C)CC54N=CCS5)OC3CC2CCC6C1CCC7(C)C(C8=CC(=O)OC8)CCC67O

Other Names for this Substance

  • Card-20(22)-enolide, 14-hydroxy-2,3-[[(5S,6R,7S,9R)-6-hydroxy-9-methyl-8-oxa-1-thia-4-azaspiro[4.5]dec-3-ene-6,7-diyl]bis(oxy)]-19-oxo-, (2α,3β,5α)-
  • Uscharin
  • Uscharine
  • Card-20(22)-enolide, 14-hydroxy-2,3-[(6-hydroxy-9-methyl-8-oxa-1-thia-4-azaspiro[4.5]dec-3-ene-6,7-diyl)bis(oxy)]-19-oxo-, [2α(5S,6R,7S,9R),3β,5α]-
  • (2α,3β,5α)-14-Hydroxy-2,3-[[(5S,6R,7S,9R)-6-hydroxy-9-methyl-8-oxa-1-thia-4-azaspiro[4.5]dec-3-ene-6,7-diyl]bis(oxy)]-19-oxocard-20(22)-enolide

Deleted or Replaced CAS Registry Numbers

1361-76-8

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