(+)-Annonacin

CAS Registry Number®

111035-65-5
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CAS Name

(+)-Annonacin

Molecular Formula

C35H64O7

Molecular Mass

596.88

Cite this Page

(+)-Annonacin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=111035-65-5 (retrieved 2024-03-28) (CAS RN: 111035-65-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    69-71 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(36)18-13-12-14-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29+,30+,31+,32+,33+,34+/m0/s1

InChIKey

InChIKey=XNODZYPOIPVPRF-CGWDHHCXSA-N

SMILES

[C@H](CCCC[C@@H](CCCCC[C@H](CC1=C[C@H](C)OC1=O)O)O)(O)[C@@]2(O[C@@]([C@@H](CCCCCCCCCCCC)O)(CC2)[H])[H]

Canonical SMILES

O=C1OC(C=C1CC(O)CCCCCC(O)CCCCC(O)C2OC(CC2)C(O)CCCCCCCCCCCC)C

Other Names for this Substance

  • 2(5H)-Furanone, 5-methyl-3-[(2R,8R,13R)-2,8,13-trihydroxy-13-[(2R,5R)-tetrahydro-5-[(1R)-1-hydroxytridecyl]-2-furanyl]tridecyl]-, (5S)-
  • 2(5H)-Furanone, 5-methyl-3-[2,8,13-trihydroxy-13-[tetrahydro-5-(1-hydroxytridecyl)-2-furanyl]tridecyl]-, [1R-[1α[1(S*),2R*,8R*,13R*],5β(R*)]]-
  • (5S)-5-Methyl-3-[(2R,8R,13R)-2,8,13-trihydroxy-13-[(2R,5R)-tetrahydro-5-[(1R)-1-hydroxytridecyl]-2-furanyl]tridecyl]-2(5H)-furanone
  • Annonacin
  • (+)-Annonacin

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