Butanoic acid, 2-hydroxy-2-methyl-3-oxo-, (3aR,4R,6aR,8S,9aR,9bR)-8-(β-D-glucopyranosyloxy)dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester, (2R)-

CAS Registry Number®

93395-31-4
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CAS Name

Butanoic acid, 2-hydroxy-2-methyl-3-oxo-, (3aR,4R,6aR,8S,9aR,9bR)-8-(β-D-glucopyranosyloxy)dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester, (2R)-

Molecular Formula

C26H34O12

Molecular Mass

538.54

Cite this Page

Butanoic acid, 2-hydroxy-2-methyl-3-oxo-, (3aR,4R,6aR,8S,9aR,9bR)-8-(β-D-glucopyranosyloxy)dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester, (2R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93395-31-4 (retrieved 2024-09-03) (CAS RN: 93395-31-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H34O12/c1-9-6-15(37-25(33)26(5,34)12(4)28)18-11(3)23(32)38-22(18)17-10(2)14(7-13(9)17)35-24-21(31)20(30)19(29)16(8-27)36-24/h13-22,24,27,29-31,34H,1-3,6-8H2,4-5H3

InChIKey

InChIKey=ZFRBQIGYWHKJRW-UHFFFAOYSA-N

SMILES

C=C1C2C3C(C(OC(C(C(C)=O)(C)O)=O)CC(=C)C2CC1OC4OC(CO)C(O)C(O)C4O)C(=C)C(=O)O3

Canonical SMILES

O=C1OC2C(C1=C)C(OC(=O)C(O)(C(=O)C)C)CC(=C)C3CC(OC4OC(CO)C(O)C(O)C4O)C(=C)C23

Other Names for this Substance

  • Butanoic acid, 2-hydroxy-2-methyl-3-oxo-, (3aR,4R,6aR,8S,9aR,9bR)-8-(β-D-glucopyranosyloxy)dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester, (2R)-
  • Butanoic acid, 2-hydroxy-2-methyl-3-oxo-, 8-(β-D-glucopyranosyloxy)dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester, [3aR-[3aα,4β(R*),6aα,8β,9aα,9bβ]]-
  • Azuleno[4,5-b]furan, butanoic acid deriv.