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Substance Name: Scutelaterin B
RN: 212069-16-4
UNII: P5U78AL68C
InChIKey: KELRNFSXNHLJGT-BUIPACDESA-N

Molecular Formula

  • C29-H42-O9

Molecular Weight

  • 534.6418
 
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Names and Synonyms

Name of Substance

  • Scutelaterin B

Synonyms

  • Butanoic acid, 2-methyl-, (1R,3S,4aR,5S,6R,8S,8aR)-8-(acetyloxy)-8a-((acetyloxy)methyl)octahydro-5,6-dimethyl-5-((2S,3aS,6aS)-2,3,3a,6a-tetrahydrofuro(2,3-b)furan-2-yl)spiro(naphthalene-1(2H),2'-oxiran)-3-yl ester
  • Scutelaterin B
  • UNII-P5U78AL68C

Registry Numbers

CAS Registry Number

  • 212069-16-4

FDA UNII

  • P5U78AL68C

System Generated Number

  • 0212069164

Structure Descriptors

InChI

1S/C29H42O9/c1-7-16(2)25(32)37-21-12-22-27(6,23-11-20-8-9-33-26(20)38-23)17(3)10-24(36-19(5)31)29(22,15-34-18(4)30)28(13-21)14-35-28/h8-9,16-17,20-24,26H,7,10-15H2,1-6H3/t16?,17-,20-,21+,22-,23+,24+,26+,27+,28+,29+/m1/s1

InChIKey

KELRNFSXNHLJGT-BUIPACDESA-N

Smiles

CCC(C)C(=O)O[C@H]1C[C@@H]2[C@@]([C@@H](C[C@@H]([C@]2([C@]3(C1)CO3)COC(=O)C)OC(=O)C)C)(C)[C@@H]4C[C@H]5C=CO[C@H]5O4