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Substance Name: Kolavenic acid
RN: 25436-90-2
InChIKey: NLVMTSRTOGOFQD-MWRQYBNOSA-N

Note

  • From Polyalthia longifolia.

Molecular Formula

  • C20-H32-O2

Molecular Weight

  • 304.471
 
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Names and Synonyms

Name of Substance

  • Kolavenic acid

Systematic Name

  • 2-Pentenoic acid, 3-methyl-5-(1,2,3,4,4a,7,8,8a-octahydro-1,2,4a,5-tetramethyl-1-naphthalenyl)-, (1S-(1alpha(E),2beta,4abeta,8aalpha))-

Registry Numbers

CAS Registry Number

  • 25436-90-2

System Generated Number

  • 0025436902

Structure Descriptors

InChI

1S/C20H32O2/c1-14(13-18(21)22)9-11-19(4)16(3)10-12-20(5)15(2)7-6-8-17(19)20/h7,13,16-17H,6,8-12H2,1-5H3,(H,21,22)/b14-13+/t16-,17-,19+,20+/m1/s1

InChIKey

NLVMTSRTOGOFQD-MWRQYBNOSA-N

Smiles

C(\C=C(\CC[C@]1([C@@H](CC[C@@]2(C(=CCC[C@H]12)C)C)C)C)C)(=O)O