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momilactone A

Properties

Image

Occurences in reactions

MNX_ID

MNXM1377187

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	2

formula

C₂₀H₂₆O₃

charge

mass

314.425

reference

chebi:49191

InChIKey

MPHXYQVSOFGNEN-JGHPTVLTSA-N

InChI

InChI=1S/C20H26O3/c1-5-18(2)8-6-13-12(11-18)10-14-16-19(13,3)9-7-15(21)20(16,4)17(22)23-14/h5,10,13-14,16H,1,6-9,11H2,2-4H3/t13-,14-,16-,18-,19-,20+/m1/s1

SMILES

[CH2:1]=[CH:5][C@:18]1([CH3:2])[CH2:8][CH2:6][C@@H:13]2[C:12](=[CH:10][C@@H:14]3[C@@H:16]4[C@:19]2([CH3:3])[CH2:9][CH2:7][C:15](=[O:21])[C@:20]4([CH3:4])[C:17](=[O:22])[O:23]3)[CH2:11]1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:49191 chebi:49191 lipidmaps:LMPR0104080002 lipidmapsM:LMPR0104080002	momilactone A 3-oxo-9beta-pimara-7,15-dien-19,6beta-olide 6beta,18-epoxy-9beta-pimara-7,15-diene-3,18-dione Momilacton A
kegg.compound:C18015 keggC:C18015	Momilactone A
hmdb:HMDB0036748	Momilactone A 3-oxo-7,15-Pimaradien-19,6-olide 3-oxo-9beta-Pimara-7,15-dien-19,6beta-olide 5-ethenyl-1,5,12-trimethyl-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-ene-11,13-dione 6beta,18-Epoxy-9beta-pimara-7,15-diene-3,18-dione Egonol primeveroside Momilacton a
seed.compound:cpd17998 seedM:cpd17998	Momilactone A momilactone A
seed.compound:cpd28882 seedM:cpd28882	momilactone A
hmdb:HMDB36748 chebi:58789 keggC:M_C18015 seedM:M_cpd17998 seedM:M_cpd28882	secondary/obsolete/fantasy identifier