Fumonisin A2

CAS Registry Number®

117415-47-1

CAS Name

Fumonisin A2

Molecular Formula

C36H61NO15

Molecular Mass

747.87

Cite this Page

Fumonisin A2.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=117415-47-1 (retrieved 2024-11-14) (CAS RN: 117415-47-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H61NO15/c1-6-7-13-22(3)34(52-33(46)19-26(36(49)50)17-31(43)44)29(51-32(45)18-25(35(47)48)16-30(41)42)15-21(2)12-10-8-9-11-14-27(39)20-28(40)23(4)37-24(5)38/h21-23,25-29,34,39-40H,6-20H2,1-5H3,(H,37,38)(H,41,42)(H,43,44)(H,47,48)(H,49,50)/t21-,22+,23-,25+,26+,27+,28-,29-,34+/m0/s1

InChIKey

InChIKey=GQCJWFPDXATUKS-WFLNFKCJSA-N

SMILES

[C@@H]([C@@H](OC(C[C@@H](CC(O)=O)C(O)=O)=O)C[C@H](CCCCCC[C@H](C[C@@H]([C@@H](NC(C)=O)C)O)O)C)(OC(C[C@@H](CC(O)=O)C(O)=O)=O)[C@@H](CCCC)C

Canonical SMILES

O=C(O)CC(C(=O)O)CC(=O)OC(CC(C)CCCCCCC(O)CC(O)C(NC(=O)C)C)C(OC(=O)CC(C(=O)O)CC(=O)O)C(C)CCCC

Other Names for this Substance

  • 1,2,3-Propanetricarboxylic acid, 1-[(1R,2S,4S,11R,13S,14S)-14-(acetylamino)-2-[(3R)-3,4-dicarboxy-1-oxobutoxy]-11,13-dihydroxy-4-methyl-1-[(1R)-1-methylpentyl]pentadecyl] ester, (2R)-
  • 1,2,3-Propanetricarboxylic acid, 1,1′-[1-[12-(acetylamino)-9,11-dihydroxy-2-methyltridecyl]-2-(1-methylpentyl)-1,2-ethanediyl] ester, [2S-[1[1R*(S*),2S*(S*),2(S*)],2R*,9S*,11R*,12R*]]-
  • 1,2,3-Propanetricarboxylic acid, 1,1′-[(1S,2R)-1-[(2S,9R,11S,12S)-12-(acetylamino)-9,11-dihydroxy-2-methyltridecyl]-2-[(1R)-1-methylpentyl]-1,2-ethanediyl] ester, (2R)-
  • Fumonisin A2

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles