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Substance Name: Lupanol 3-beta-diglucoside
RN: 120527-58-4
InChIKey: SQLBDGHCDJLXIZ-LEKZHJJBSA-N

Molecular Formula

  • C42-H72-O11

Molecular Weight

  • 753.02
 
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Names and Synonyms

Results Name

  • Lupanol 3-beta-diglucoside

Synonym

  • Lupanol 3-beta-diglucoside

Systematic Name

  • beta-D-Glucopyranoside, (3beta)-lupan-3-yl O-beta-D-glucopyranosyl-

Registry Numbers

CAS Registry Number

  • 120527-58-4

System Generated Number

  • 0120527584

Structure Descriptors

InChI

1S/C42H72O11/c1-21(2)22-11-14-38(5)17-18-40(7)23(29(22)38)9-10-28-39(6)15-12-27(37(3,4)26(39)13-16-41(28,40)8)42(35(50)33(48)31(46)25(20-44)52-42)53-36-34(49)32(47)30(45)24(19-43)51-36/h21-36,43-50H,9-20H2,1-8H3/t22-,23+,24+,25+,26-,27?,28?,29+,30+,31+,32-,33-,34+,35+,36-,38+,39-,40+,41+,42-/m0/s1

InChIKey

SQLBDGHCDJLXIZ-LEKZHJJBSA-N

Smiles

O([C@]1([C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)[C@@H]1CC[C@@]2([C@@H]3CC[C@@H]4[C@H]5[C@@H](CC[C@@]5(CC[C@@]4([C@@]3(CC[C@@H]2C1(C)C)C)C)C)C(C)C)C)[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO