Oraposide

CAS Registry Number®

61276-16-2
No image available.

CAS Name

Oraposide

Molecular Formula

C29H34O15

Molecular Mass

622.57

Cite this Page

Oraposide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61276-16-2 (retrieved 2024-09-19) (CAS RN: 61276-16-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H34O15/c1-12-22(36)23(37)24(38)28(40-12)44-26-25(43-21(35)7-3-13-2-5-15(31)17(33)8-13)19(10-30)42-29-27(26)41-20(11-39-29)14-4-6-16(32)18(34)9-14/h2-9,12,19-20,22-34,36-38H,10-11H2,1H3/b7-3+/t12-,19+,20+,22-,23+,24+,25+,26-,27+,28-,29+/m0/s1

InChIKey

InChIKey=FPOYEEKZOOLVJA-WLLRULDYSA-N

SMILES

O([C@@H]1[C@@]2([C@@](O[C@H](CO)[C@H]1OC(/C=C/C3=CC(O)=C(O)C=C3)=O)(OC[C@@H](O2)C4=CC(O)=C(O)C=C4)[H])[H])[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5

Canonical SMILES

O=C(OC1C(OC2OCC(OC2C1OC3OC(C)C(O)C(O)C3O)C4=CC=C(O)C(O)=C4)CO)C=CC5=CC=C(O)C(O)=C5

Other Names for this Substance

  • β-D-Glucopyranose, 3-O-(6-deoxy-α-L-mannopyranosyl)-1,2-O-[(2S)-2-(3,4-dihydroxyphenyl)-1,2-ethanediyl]-, 4-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]
  • β-D-Glucopyranose, 3-O-(6-deoxy-α-L-mannopyranosyl)-1,2-O-[2-(3,4-dihydroxyphenyl)-1,2-ethanediyl]-, 4-[3-(3,4-dihydroxyphenyl)-2-propenoate], [1(S),4(E)]-
  • Orobanchoside
  • Crenatoside
  • Oraposide

Deleted or Replaced CAS Registry Numbers

138215-09-5, 145985-09-7