Kauran-18-oic acid, 17-(β-D-glucopyranosyloxy)-6,7,13,16-tetrahydroxy-, (4α,6β,7β)-

CAS Registry Number®

316141-31-8
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CAS Name

Kauran-18-oic acid, 17-(β-D-glucopyranosyloxy)-6,7,13,16-tetrahydroxy-, (4α,6β,7β)-

Molecular Formula

C26H42O12

Molecular Mass

546.60

Cite this Page

Kauran-18-oic acid, 17-(β-D-glucopyranosyloxy)-6,7,13,16-tetrahydroxy-, (4α,6β,7β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=316141-31-8 (retrieved 2024-09-20) (CAS RN: 316141-31-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H42O12/c1-22-5-3-6-23(2,21(33)34)18(22)17(31)19(32)24-9-25(35,7-4-13(22)24)26(36,10-24)11-37-20-16(30)15(29)14(28)12(8-27)38-20/h12-20,27-32,35-36H,3-11H2,1-2H3,(H,33,34)/t12-,13+,14-,15+,16-,17+,18+,19+,20-,22+,23-,24-,25+,26+/m1/s1

InChIKey

InChIKey=HVFLAHBPOQXZBM-BNYFHCFRSA-N

SMILES

O[C@@H]1[C@]23[C@]([C@@]4(C)[C@]([C@@H]1O)([C@@](C(O)=O)(C)CCC4)[H])(CC[C@](O)(C2)[C@](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)(O)C3)[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C3CCC4(O)CC3(CC4(O)COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C12

Other Names for this Substance

  • Kauran-18-oic acid, 17-(β-D-glucopyranosyloxy)-6,7,13,16-tetrahydroxy-, (4α,6β,7β)-
  • Canavalioside