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Substance Name: 7beta,8beta-Epoxyisororidin E
RN: 64687-83-8
UNII: M2OAT84FAG
InChIKey: SVPSTMIMOGGJOG-LUGVTPJISA-N

Molecular Formula

  • C29-H36-O9

Molecular Weight

  • 528.5944
 
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Names and Synonyms

Name of Substance

  • 7beta,8beta-Epoxyisororidin E

Synonyms

  • 7beta,8beta-Epoxyisororidin E
  • Epoxyisororidin E
  • UNII-M2OAT84FAG
  • Verrucarin A, 2',3'-didehydro-7'-deoxo-2'-deoxy-7,8-epoxy-7'-((1R)-1-hydroxyethyl)-, (2'E,7R,7'S,8S)-

Registry Numbers

CAS Registry Number

  • 64687-83-8

FDA UNII

  • M2OAT84FAG

System Generated Number

  • 0064687838

Structure Descriptors

InChI

1S/C29H36O9/c1-16-9-10-33-19(18(3)30)7-5-6-8-23(31)37-20-13-22-29(15-35-29)27(20,4)28(14-34-24(32)11-16)21(36-22)12-17(2)25-26(28)38-25/h5-8,11-12,18-22,25-26,30H,9-10,13-15H2,1-4H3/b7-5+,8-6-,16-11+/t18-,19+,20-,21-,22-,25+,26+,27-,28-,29+/m1/s1

InChIKey

SVPSTMIMOGGJOG-LUGVTPJISA-N

Smiles

C[C@@H](O)[C@H]1OCC\C(=C\C(=O)OC[C@]23[C@H](O[C@@H]4C[C@@H](OC(=O)\C=C/C=C/1)[C@@]2(C)[C@]45CO5)C=C(C)[C@@H]6O[C@H]36)\C