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Substance Name: Aspochalasin D
RN: 71968-02-0
InChIKey: GCIKKGSNXSCKCP-IJDGJKBTSA-N

Note

  • From Aspergillus sp.

Molecular Weight

  • 401.543
 
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Names and Synonyms

Results Name

  • Aspochalasin D

Synonym

  • Aspochalasin D

Systematic Name

  • 1H-Cycloundec(d)isoindole-1,15(2H)-dione, 3,3a,4,6a,9,10,11,12-octahydro-11,12-dihydroxy-4,5,8-trimethyl-3-(2-methylpropyl)-, (3S,3aR,4S,6aS,7E,11R,12S,13E,15aS)-

Registry Numbers

CAS Registry Number

  • 71968-02-0

System Generated Number

  • 0071968020

Structure Descriptors

InChI

1S/C24H35NO4/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8-,14-11-/t16-,17+,18+,19-,20+,22+,24-/m1/s1

InChIKey

GCIKKGSNXSCKCP-IJDGJKBTSA-N

Smiles

N1[C@H]([C@@H]2[C@@H](C(=C[C@H]3[C@@]2(C1=O)C(C=C[C@@H]([C@@H](CCC(=C3)C)O)O)=O)C)C)CC(C)C