1H,6H-Pyrazino[1,2-a:4,5-a′]diindole-1,6,8,13(4H,6aH)-tetrone, 4a,7,7a,11,11a,13a,14,14a-octahydro-4,11-dihydroxy-6a,13a-bis(methylthio)-, (4R,4aR,6aS,7aR,11R,11aR,13aS,14aR)-rel-(-)-

CAS Registry Number®

99572-22-2

CAS Name

1H,6H-Pyrazino[1,2-a:4,5-a′]diindole-1,6,8,13(4H,6aH)-tetrone, 4a,7,7a,11,11a,13a,14,14a-octahydro-4,11-dihydroxy-6a,13a-bis(methylthio)-, (4R,4aR,6aS,7aR,11R,11aR,13aS,14aR)-rel-(-)-

Molecular Formula

C20H22N2O6S2

Molecular Mass

450.53

Cite this Page

1H,6H-Pyrazino[1,2-a:4,5-a′]diindole-1,6,8,13(4H,6aH)-tetrone, 4a,7,7a,11,11a,13a,14,14a-octahydro-4,11-dihydroxy-6a,13a-bis(methylthio)-, (4R,4aR,6aS,7aR,11R,11aR,13aS,14aR)-rel-(-)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=99572-22-2 (retrieved 2024-11-08) (CAS RN: 99572-22-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H22N2O6S2/c1-29-19-7-9-11(23)3-5-13(25)15(9)21(19)18(28)20(30-2)8-10-12(24)4-6-14(26)16(10)22(20)17(19)27/h3-6,9-10,13-16,25-26H,7-8H2,1-2H3/t9-,10-,13+,14+,15+,16+,19-,20-/m0/s1

InChIKey

InChIKey=FWPMSYUTOOUASJ-GFIYPFTLSA-N

SMILES

S(C)[C@@]12N([C@@]3([C@@](C1)(C(=O)C=C[C@H]3O)[H])[H])C(=O)[C@]4(SC)N(C2=O)[C@@]5([C@@](C4)(C(=O)C=C[C@H]5O)[H])[H]

Canonical SMILES

O=C1C=CC(O)C2N3C(=O)C4(SC)N(C(=O)C3(SC)CC12)C5C(O)C=CC(=O)C5C4

Other Names for this Substance

  • 1H,6H-Pyrazino[1,2-a:4,5-a′]diindole-1,6,8,13(4H,6aH)-tetrone, 4a,7,7a,11,11a,13a,14,14a-octahydro-4,11-dihydroxy-6a,13a-bis(methylthio)-, (4R,4aR,6aS,7aR,11R,11aR,13aS,14aR)-rel-(-)-
  • 1H,6H-Pyrazino[1,2-a:4,5-a′]diindole-1,6,8,13(4H,6aH)-tetrone, 4a,7,7a,11,11a,13a,14,14a-octahydro-4,11-dihydroxy-6a,13a-bis(methylthio)-, (4α,4aα,6aβ,7aβ,11α,11aα,13aβ,14aβ)-(-)-
  • Exserohilone
  • (-)-Exserohilone
  • NSC 610629

CAS INSIGHTSTM
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