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Substance Name: Periplocoside B
RN: 115743-49-2
InChIKey: LPSOSXGOHMUVDT-UHFFFAOYSA-N

Note

  • Isolated from Periploca sepium.

Molecular Formula

  • C56-H88-O19

Molecular Weight

  • 1065.29
 
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Names and Synonyms

Name of Substance

  • Periplocoside B

Systematic Name

  • 2H-Pyran-3(6H)-one, 2-(((3beta,20S)-20-((5-((2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl)-3-O-methyl-beta-D-ribo-hexopyranosyl)oxy)tetrahydro-4-methoxy-6,9'-dimethylspiro(2H-pyran-2,3'(4'H)-(7H)pyrano(3,4-c)(1,2,5)trioxepin)-7'-yl)oxy)-17-hydroxypregn-5-en-3-yl)oxy)-4-methoxy-6-methyl-, (3'S-(3'alpha(4S*,5S*,6S*),5'abeta,7'alpha(6S*),9'alpha,9'aalpha))-

Registry Numbers

CAS Registry Number

  • 115743-49-2

System Generated Number

  • 0115743492

Structure Descriptors

InChI

1S/C56H88O19/c1-28-21-39(60-9)48(58)52(65-28)70-35-15-18-53(7)34(22-35)13-14-36-37(53)16-19-54(8)38(36)17-20-56(54,59)33(6)69-44-25-42-51(31(4)68-44)74-75-55(27-64-42)26-43(63-12)50(32(5)73-55)72-46-24-41(62-11)49(30(3)67-46)71-45-23-40(61-10)47(57)29(2)66-45/h13,21,28-33,35-38,40-47,49-52,57,59H,14-20,22-27H2,1-12H3

InChIKey

LPSOSXGOHMUVDT-UHFFFAOYSA-N

Smiles

O[C@@H]1[C@@H](C[C@@H](O[C@@H]2[C@@H](C[C@@H](O[C@@H]2C)O[C@@H]2[C@@H](C[C@@]3(O[C@@H]2C)CO[C@@H]2C[C@@H](O[C@@H]([C@@H]2OO3)C)O[C@@H]([C@@]2(CC[C@@H]3[C@@H]4CC=C5[C@@]([C@@H]4CC[C@@]23C)(C)CC[C@@H](O[C@@H]2C(C(=C[C@@H](O2)C)OC)=O)C5)O)C)OC)OC)O[C@@H]1C)OC