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Substance Name: Deutzicoside A
RN: 137551-41-8
InChIKey: DFBQUTBOVLBEHN-OOLIYSFKSA-N

Note

  • From Deutzia corymbosa.

Molecular Weight

  • 736.934
 
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Names and Synonyms

Name of Substance

  • Deutzicoside A

Synonym

  • Echinocystic acid-3-O-(arabinopyranosyl(1-4))-arabinopyranoside

Systematic Name

  • Olean-12-en-28-oic acid, 3-((4-O-alpha-L-arabinopyranosyl-alpha-L-arabinopyranosyl)oxy)-16-hydroxy-, (3beta,16alpha)-

Registry Numbers

CAS Registry Number

  • 137551-41-8

System Generated Number

  • 0137551418

Structure Descriptors

InChI

1S/C40H64O12/c1-35(2)14-15-40(34(47)48)21(16-35)20-8-9-25-37(5)12-11-27(36(3,4)24(37)10-13-38(25,6)39(20,7)17-26(40)42)52-33-31(46)29(44)23(19-50-33)51-32-30(45)28(43)22(41)18-49-32/h8,21-33,41-46H,9-19H2,1-7H3,(H,47,48)/t21-,22+,23+,24?,25-,26-,27+,28+,29+,30-,31-,32+,33+,37+,38-,39-,40-/m1/s1

InChIKey

DFBQUTBOVLBEHN-OOLIYSFKSA-N

Smiles

C1[C@@H](C(C)(C)[C@@H]2CC[C@@]3(C)[C@]4(C)C[C@H]([C@@]5(C(=O)O)CCC(C)(C)C[C@H]5C4=CC[C@H]3[C@@]2(C1)C)O)O[C@H]1[C@H](O)[C@@H](O)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)CO2)CO1