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Substance Name: Sieboldianoside B
RN: 152407-00-6
InChIKey: GROQHEZXWUJYNW-ITUQRZNASA-N

Note

  • From leaves of Acanthopanax sieboldianus.

Molecular Weight

  • 1337.5
 
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Names and Synonyms

Name of Substance

  • Sieboldianoside B

Synonym

  • Oleanolic acid 3-O-beta-D-xylopyranosyl(1-3)-alpha-L-rhamnopyranosyl(1-2)-alpha-L-arabinopyranoside

Systematic Name

  • Olean-12-en-28-oic acid, 3-((O-beta-D-xylopyranosyl-(1-3)-O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-alpha-L-arabinopyranosyl)oxy)-, O-6-deoxy-alpha-L-mannopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-beta-D-glucopyran

Registry Numbers

CAS Registry Number

  • 152407-00-6

System Generated Number

  • 0152407006

Structure Descriptors

InChI

1S/C64H104O29/c1-25-36(68)41(73)45(77)54(85-25)90-49-31(21-65)87-52(47(79)43(49)75)84-24-32-40(72)42(74)46(78)55(88-32)93-58(81)64-18-16-59(3,4)20-28(64)27-10-11-34-61(7)14-13-35(60(5,6)33(61)12-15-63(34,9)62(27,8)17-19-64)89-57-51(39(71)30(67)23-83-57)92-56-48(80)50(37(69)26(2)86-56)91-53-44(76)38(70)29(66)22-82-53/h10,25-26,28-57,65-80H,11-24H2,1-9H3/t25-,26-,28-,29+,30-,31+,32+,33-,34+,35-,36-,37-,38-,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,61-,62+,63+,64-/m0/s1

InChIKey

GROQHEZXWUJYNW-ITUQRZNASA-N

Smiles

O([C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)[C@H]1[C@H]([C@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4([C@H](C3(C)C)CC[C@@]3(C)[C@@H]4CC=C4[C@@]3(C)CC[C@@]3(C(O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)CO[C@@H]5O[C@H](CO)[C@H]([C@@H]([C@H]5O)O)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)O)O)O)=O)[C@H]4CC(CC3)(C)C)C)OC[C@@H]([C@@H]2O)O)O[C@H]([C@@H]1O)C)O