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Substance Name: beta-D-Glucopyranoside, (3b,20b)-11,29-dihydroxyolean-12-en-3-yl 2-O-beta-D-glucopyranosyl-
RN: 134250-16-1
InChIKey: CGWSUZFSADHCPF-LZILMHEWSA-N

Molecular Formula

  • C42-H70-O13

Molecular Weight

  • 783.002
 
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Names and Synonyms

Synonym

  • 18beta-Olean-12-ene-3beta,11xi,30-triol-3-O-beta-D-glucopyranosyl(1-2)beta-D-glucopyranoside

Systematic Name

  • beta-D-Glucopyranoside, (3b,20b)-11,29-dihydroxyolean-12-en-3-yl 2-O-beta-D-glucopyranosyl-

Registry Numbers

CAS Registry Number

  • 134250-16-1

System Generated Number

  • 0134250161

Structure Descriptors

InChI

1S/C42H70O13/c1-37(2)26-8-11-42(7)34(23(46)16-21-22-17-38(3,20-45)12-13-39(22,4)14-15-41(21,42)6)40(26,5)10-9-27(37)54-36-33(31(50)29(48)25(19-44)53-36)55-35-32(51)30(49)28(47)24(18-43)52-35/h16,22-36,43-51H,8-15,17-20H2,1-7H3/t22-,23?,24+,25+,26-,27-,28+,29+,30-,31-,32+,33+,34+,35-,36+,38-,39+,40-,41+,42+/m0/s1

InChIKey

CGWSUZFSADHCPF-LZILMHEWSA-N

Smiles

C[C@]12CC[C@](C[C@H]1C3=CC([C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)O)(C)CO