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Substance Name: O-Rhamnosyl-(1''-4')wedeloside
RN: 74686-31-0
InChIKey: ZHWHQGPOENZPRA-LDVPZJJESA-N

Note

  • From Wedellia asperrima; toxic cpd.

Molecular Formula

  • C46-H65-N-O17

Molecular Weight

  • 904.01
 
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Names and Synonyms

Name of Substance

  • O-Rhamnosyl-(1''-4')wedeloside

Synonym

  • RHWE

Registry Numbers

CAS Registry Number

  • 74686-31-0

System Generated Number

  • 0074686310

Structure Descriptors

InChI

1S/C46H65NO17/c1-22(2)17-30(49)47-32-37(63-31(50)12-11-25-9-7-6-8-10-25)36(64-40-35(53)34(52)33(51)24(4)60-40)27(20-48)62-39(32)61-26-18-43(5)28-14-16-45(59)21-44(28,38(54)23(45)3)15-13-29(43)46(19-26,41(55)56)42(57)58/h6-10,22,24,26-29,32-40,48,51-54,59H,3,11-21H2,1-2,4-5H3,(H,47,49)(H,55,56)(H,57,58)/t24-,26-,27+,28-,29-,32+,33-,34+,35+,36+,37+,38-,39+,40-,43-,44?,45-/m0/s1

InChIKey

ZHWHQGPOENZPRA-LDVPZJJESA-N

Smiles

C1[C@H]2[C@@]3([C@H](CC[C@@]42[C@H](C([C@@](O)(C4)C1)=C)O)C(C(O)=O)(C(O)=O)C[C@H](O[C@H]1[C@H](NC(CC(C)C)=O)[C@@H](OC(CCc2ccccc2)=O)[C@H](O[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)O)O)O)[C@H](CO)O1)C3)C