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Substance Name: Chaetoglobosin B
RN: 50335-04-1
InChIKey: VUEFRYQBOMQOMV-CGCQETNGSA-N

Molecular Formula

  • C32-H36-N2-O5

Molecular Weight

  • 528.645
 
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Names and Synonyms

Results Name

  • Chaetoglobosin B

Synonyms

  • (7S,13E,16S,17E,19R,21E)-7,19-Dihydroxy-10-(1H-indol-3-yl)-16,18-dimethyl-(13)cytochalasa-5,13,17,21-tetraene-1,20,23-trione
  • Chaetoglobosin B

Systematic Names

  • (13)Cytochalasa-5,13,17,21-tetraene-1,20,23-trione, 7,19-dihydroxy-10-(1H-indol-3-yl)-16,18-dimethyl-, (7S,13E,16S,17E,19R,21E)-
  • 1H-Cyclotridec(d)isoindole-1,14,17-trione, 2,3,3a,6,6a,9,10,13-octahydro-6,13-dihydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-, (3S,3aR,6S,6aR,7E,10S,11E,13R,17aR)-

Registry Numbers

CAS Registry Number

  • 50335-04-1

System Generated Number

  • 0050335041

Structure Descriptors

InChI

1S/C32H36N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-14,16-17,23,25,28-30,33,37-38H,8,15H2,1-4H3,(H,34,39)/b10-7+,13-12+,18-14-/t17-,23-,25-,28-,29+,30+,32+/m0/s1

InChIKey

VUEFRYQBOMQOMV-CGCQETNGSA-N

Smiles

C1(=O)C=CC([C@@H](C(=C[C@H](CC=C[C@@H]2[C@]31C(N[C@H]([C@@H]3C(=C([C@H]2O)C)C)Cc1c[nH]c2ccccc12)=O)C)C)O)=O