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Substance Name: Songarosaponin A
RN: 141565-05-1
InChIKey: QUZUQSXPOSEUDF-UHFFFAOYSA-N

Note

  • Oleane from Verbascum songaricum.

Molecular Weight

  • 1073.27
 
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Names and Synonyms

Name of Substance

  • Songarosaponin A

Synonym

  • 3-O-((alpha-L-Rhamnopyranosyl(1-4)-beta-D-glucopyranosyl(1-3))-(beta-D-glucopyranosyl(1-2))-beta-D-fucopyranosyl)-olea-11,13-diene-3,23,28-triol

Registry Numbers

CAS Registry Number

  • 141565-05-1

System Generated Number

  • 0141565051

Structure Descriptors

InChI

1S/C54H88O21/c1-24-33(59)36(62)39(65)45(68-24)73-42-29(21-56)71-47(41(67)38(42)64)74-43-34(60)25(2)69-48(44(43)75-46-40(66)37(63)35(61)28(20-55)70-46)72-32-12-13-50(5)30(51(32,6)22-57)11-14-53(8)31(50)10-9-26-27-19-49(3,4)15-17-54(27,23-58)18-16-52(26,53)7/h9-10,24-25,28-48,55-67H,11-23H2,1-8H3

InChIKey

QUZUQSXPOSEUDF-UHFFFAOYSA-N

Smiles

O[C@@H]1[C@@H](O[C@@H]2[C@@H]([C@@H]([C@@H](O[C@@H]3[C@@H]([C@@H](O[C@@H](O[C@@H]4[C@@]([C@@H]5CC[C@@]6([C@@]7(CC[C@@]8(CO)CCC(C)(C)CC8=C7C=C[C@@H]6[C@@]5(CC4)C)C)C)(CO)C)[C@@H]3O[C@@H]3[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O3)C)O)O[C@@H]2CO)O)O)O[C@@H]([C@@H](O)[C@@H]1O)C