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Substance Name: Periplocoside A
RN: 114828-46-5
InChIKey: RTMAZVHPRZLMEU-UHFFFAOYSA-N

Note

  • Isolated from Periploca sepium.

Molecular Formula

  • C72-H114-O27

Molecular Weight

  • 1411.67
 
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Names and Synonyms

Name of Substance

  • Periplocoside A

Systematic Name

  • 2H-Pyran-3(6H)-one, 2-(((3beta,20S)-20-((5-((O-2-O-acetyl-6-deoxy-3-O-methyl-beta-D-galactopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-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

  • 114828-46-5

System Generated Number

  • 0114828465

Structure Descriptors

InChI

1S/C72H114O27/c1-34-26-48(77-12)59(75)67(84-34)92-44-20-23-69(10)43(27-44)18-19-45-46(69)21-24-70(11)47(45)22-25-72(70,76)41(8)90-54-31-52-64(39(6)88-54)98-99-71(33-83-52)32-53(81-16)63(40(7)97-71)95-57-29-50(79-14)61(37(4)86-57)93-55-28-49(78-13)60(36(3)85-55)94-56-30-51(80-15)62(38(5)87-56)96-68-66(91-42(9)73)65(82-17)58(74)35(2)89-68/h18,26,34-41,44-47,49-58,60-68,74,76H,19-25,27-33H2,1-17H3

InChIKey

RTMAZVHPRZLMEU-UHFFFAOYSA-N

Smiles

O1[C@@]2(C[C@@H]([C@@H](O[C@@H]3C[C@@H]([C@@H]([C@@H](O3)C)O[C@@H]3O[C@@H]([C@@H]([C@@H](C3)OC)O[C@@H]3C[C@@H]([C@@H]([C@@H](O3)C)O[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@@H]3OC(C)=O)OC)C)OC)C)OC)[C@@H]1C)OC)CO[C@@H]1C[C@@H](O[C@@H]([C@@H]1OO2)C)O[C@@H]([C@@]1(CC[C@@H]2[C@@H]3CC=C4C[C@@H](CC[C@@]4([C@@H]3CC[C@@]12C)C)O[C@@H]1C(C(=C[C@@H](O1)C)OC)=O)O)C