1,2,3-Propanetricarboxylic acid, 1-[13-(acetylamino)-5,10,12-trihydroxy-3-methyl-1-(2-methyl-1-oxohexyl)tetradecyl] ester

CAS Registry Number®

170591-49-8
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CAS Name

1,2,3-Propanetricarboxylic acid, 1-[13-(acetylamino)-5,10,12-trihydroxy-3-methyl-1-(2-methyl-1-oxohexyl)tetradecyl] ester

Molecular Formula

C30H53NO11

Molecular Mass

603.74

Cite this Page

1,2,3-Propanetricarboxylic acid, 1-[13-(acetylamino)-5,10,12-trihydroxy-3-methyl-1-(2-methyl-1-oxohexyl)tetradecyl] ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=170591-49-8 (retrieved 2024-09-20) (CAS RN: 170591-49-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H53NO11/c1-6-7-10-19(3)29(39)26(42-28(38)16-22(30(40)41)15-27(36)37)14-18(2)13-23(33)11-8-9-12-24(34)17-25(35)20(4)31-21(5)32/h18-20,22-26,33-35H,6-17H2,1-5H3,(H,31,32)(H,36,37)(H,40,41)

InChIKey

InChIKey=QROJNSDGLZKJGS-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1,2,3-Propanetricarboxylic acid, 1-[13-(acetylamino)-5,10,12-trihydroxy-3-methyl-1-(2-methyl-1-oxohexyl)tetradecyl] ester
  • Fumonisin AK1