rel-(4R,5R,6R)-5-[8,10-Dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethyl-2-cyclohexen-1-one

CAS Registry Number®

189156-42-1

CAS Name

rel-(4R,5R,6R)-5-[8,10-Dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethyl-2-cyclohexen-1-one

Molecular Formula

C26H48O5

Molecular Mass

440.66

Cite this Page

rel-(4R,5R,6R)-5-[8,10-Dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethyl-2-cyclohexen-1-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=189156-42-1 (retrieved 2025-01-12) (CAS RN: 189156-42-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H48O5/c1-7-20(17-27)24(30)16-23(29)19(4)12-11-18(3)10-9-14-25(5)21(8-2)22(28)13-15-26(25,6)31/h13,15,18-21,23-24,27,29-31H,7-12,14,16-17H2,1-6H3/t18?,19?,20?,21-,23?,24?,25+,26+/m1/s1

InChIKey

InChIKey=HDAGCVMZABLHLE-UEAWNLQISA-N

SMILES

C(CCC(CCC(C(CC(C(CC)CO)O)O)C)C)[C@@]1(C)[C@H](CC)C(=O)C=C[C@]1(C)O

Canonical SMILES

O=C1C=CC(O)(C)C(C)(CCCC(C)CCC(C)C(O)CC(O)C(CO)CC)C1CC

Other Names for this Substance

  • 2-Cyclohexen-1-one, 5-[8,10-dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethyl-, (4R,5R,6R)-rel-
  • rel-(4R,5R,6R)-5-[8,10-Dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethyl-2-cyclohexen-1-one
  • Momordol

CAS INSIGHTSTM
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