Met006976: Moniliforminol B
Metabolite Information
Name
Moniliforminol B
IUPAC Name
(E)-8-[(1S,3S,6R)-3,6-dihydroxy-2,2,6-trimethylcyclohexyl]-6-methyloct-5-en-2-one
Molecular Formula
C18H32O3
Molecular Weight
296.4
Exact Mass
296.2351449
SMILES
CC(=CCCC(=O)C)CCC1C(C(CCC1(C)O)O)(C)C
InChIKey
SKDGJZCQTPSFAG-RMMJXNQTSA-N
InChI
InChI=1S/C18H32O3/c1-13(7-6-8-14(2)19)9-10-15-17(3,4)16(20)11-12-18(15,5)21/h7,15-16,20-21H,6,8-12H2,1-5H3/b13-7+/t15-,16-,18+/m0/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Prenol lipids
Subclass:
Sesquiterpenoids
Crops containing this metabolite
banana
broccoli
grape
mango
peach
tomato
turnip
yam
broccoli
grape
mango
peach
tomato
turnip
yam
Metabolite Spectrum Accession Label
BAN00005p
BAN00122p
BAN00224p
BAN00309p
BAN00394p
BROC00133p
BROC00181p
BROC00386p
BROC00481p
BROC00643p
GRA00005p
GRA00016p
GRA00119p
GRA00199p
GRA00374p
GRA00375p
GRA00471p
MAN00001p
MAN00027p
MAN00040p
MAN00117p
MAN00581p
PEACH00099p
PEACH00291p
PEACH00371p
TOM00084p
TOM00352p
TUR00015p
TUR00049p
TUR00082p
TUR00083p
TUR00104p
TUR00109p
TUR00148p
TUR00166p
TUR00229p
TUR00239p
TUR00303p
TUR00319p
TUR00341p
TUR00372p
TUR00437p
TUR00443p
TUR00480p
YAM00011p
YAM00027p
YAM00225p
YAM00350p
YAM00365p
BAN00122p
BAN00224p
BAN00309p
BAN00394p
BROC00133p
BROC00181p
BROC00386p
BROC00481p
BROC00643p
GRA00005p
GRA00016p
GRA00119p
GRA00199p
GRA00374p
GRA00375p
GRA00471p
MAN00001p
MAN00027p
MAN00040p
MAN00117p
MAN00581p
PEACH00099p
PEACH00291p
PEACH00371p
TOM00084p
TOM00352p
TUR00015p
TUR00049p
TUR00082p
TUR00083p
TUR00104p
TUR00109p
TUR00148p
TUR00166p
TUR00229p
TUR00239p
TUR00303p
TUR00319p
TUR00341p
TUR00372p
TUR00437p
TUR00443p
TUR00480p
YAM00011p
YAM00027p
YAM00225p
YAM00350p
YAM00365p