Ambuic acid

CAS Registry Number®

340774-69-8
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CAS Name

Ambuic acid

Molecular Formula

C19H26O6

Molecular Mass

350.41

Cite this Page

Ambuic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=340774-69-8 (retrieved 2024-09-07) (CAS RN: 340774-69-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H26O6/c1-3-4-5-6-7-8-13-14(11-20)15(21)17-19(25-17,16(13)22)10-9-12(2)18(23)24/h7-9,15,17,20-21H,3-6,10-11H2,1-2H3,(H,23,24)/b8-7+,12-9+/t15-,17-,19+/m1/s1

InChIKey

InChIKey=UDSQZJMGPSRCEM-HDKVZZTHSA-N

SMILES

C(/C=C(/C(O)=O)\C)[C@]12[C@](O1)([C@H](O)C(CO)=C(/C=C/CCCCC)C2=O)[H]

Canonical SMILES

O=C(O)C(=CCC12OC2C(O)C(=C(C=CCCCCC)C1=O)CO)C

Other Names for this Substance

  • 2-Butenoic acid, 4-[(1R,5R,6R)-3-(1E)-1-hepten-1-yl-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methyl-, (2E)-
  • 2-Butenoic acid, 4-[(1R,5R,6R)-3-(1E)-1-heptenyl-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methyl-, (2E)-
  • (2E)-4-[(1R,5R,6R)-3-(1E)-1-Hepten-1-yl-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methyl-2-butenoic acid
  • Ambuic acid
  • (+)-Ambuic acid