sec-O-Glucosylhamaudol

CAS Registry Number®

80681-44-3
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CAS Name

sec-O-Glucosylhamaudol

Molecular Formula

C21H26O10

Molecular Mass

438.43

Cite this Page

sec-O-Glucosylhamaudol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80681-44-3 (retrieved 2024-07-08) (CAS RN: 80681-44-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H26O10/c1-8-4-10(23)15-12(28-8)6-11-9(16(15)24)5-14(21(2,3)31-11)30-20-19(27)18(26)17(25)13(7-22)29-20/h4,6,13-14,17-20,22,24-27H,5,7H2,1-3H3/t13-,14+,17-,18+,19-,20+/m1/s1

InChIKey

InChIKey=QVUPQEXKTXSMKX-JJDILSOYSA-N

SMILES

OC1=C2C(=CC3=C1C(=O)C=C(C)O3)OC(C)(C)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C2

Canonical SMILES

O=C1C=C(OC=2C=C3OC(C)(C)C(OC4OC(CO)C(O)C(O)C4O)CC3=C(O)C12)C

Other Names for this Substance

  • 2H,6H-Benzo[1,2-b:5,4-b′]dipyran-6-one, 3-(β-D-glucopyranosyloxy)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-, (3S)-
  • 2H,6H-Benzo[1,2-b:5,4-b′]dipyran-6-one, 3-(β-D-glucopyranosyloxy)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-, (S)-
  • (3S)-3-(β-D-Glucopyranosyloxy)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-2H,6H-benzo[1,2-b:5,4-b′]dipyran-6-one
  • sec-O-Glucosylhamaudol

Deleted or Replaced CAS Registry Numbers

84272-86-6