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Substance Name: Pseudopterosin B
RN: 104855-21-2
UNII: 1K8U30F50A
InChIKey: UDURMGJKGORCRS-PSXKBTAYSA-N

Molecular Formula

  • C27-H38-O7

Molecular Weight

  • 474.5902
 
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Names and Synonyms

Name of Substance

  • Pseudopterosin B

Synonyms

  • (3S,7R,9S,9aR)-2,3,7,8,9,9a-Hexahydro-5-hydroxy-3,6,9-trimethyl-7-(2-methyl-1-propenyl)-1H-phenalen-4-yl-beta-D-xylopyranoside 2-acetate
  • beta-D-Xylopyranoside, (3S,7R,9S,9aR)-2,3,7,8,9,9a-hexahydro-5-hydroxy-3,6,9-trimethyl-7-(2-methyl-1-propen-1-yl)-1H-phenalen-4-yl, 2-acetate
  • Pseudopterosin B
  • Pseudopterosin B [MI]
  • UNII-1K8U30F50A

Registry Numbers

CAS Registry Number

  • 104855-21-2

FDA UNII

  • 1K8U30F50A

System Generated Number

  • 0104855212

Structure Descriptors

InChI

1S/C27H38O7/c1-12(2)9-17-10-14(4)18-8-7-13(3)20-22(18)21(17)15(5)23(30)25(20)34-27-26(33-16(6)28)24(31)19(29)11-32-27/h9,13-14,17-19,24,26-27,29-31H,7-8,10-11H2,1-6H3/t13-,14-,17-,18+,19+,24-,26+,27-/m0/s1

InChIKey

UDURMGJKGORCRS-PSXKBTAYSA-N

Smiles

Cc1c2c3c(c(c1O)O[C@H]4[C@@H]([C@H]([C@@H](CO4)O)O)OC(=O)C)[C@H](CC[C@@H]3[C@H](C[C@@H]2C=C(C)C)C)C