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compactin diol lactone

Properties

Image

Occurences in reactions

MNX_ID

MNXM47544

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

formula

C₁₈H₂₆O₄

charge

mass

306.18311

reference

chebi:34652

InChIKey

WWSNTLOVYSRDEL-DZSDEGEFSA-N

InChI

InChI=1S/C18H26O4/c1-11-5-6-12-3-2-4-16(20)18(12)15(11)8-7-14-9-13(19)10-17(21)22-14/h3,5-6,11,13-16,18-20H,2,4,7-10H2,1H3/t11-,13+,14+,15-,16-,18-/m0/s1

SMILES

C[C@H]1C=CC2=CCC[C@H](O)[C@@H]2[C@H]1CC[C@@H]1C[C@@H](O)CC(=O)O1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:34652 chebi:34652	compactin diol lactone (4R,6R)-4-hydroxy-6-{2-[(1S,2S,8S,8aR)-8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl}oxan-2-one (4R,6R)-4-hydroxy-6-{2-[(1S,2S,8S,8aR)-8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl}tetrahydro-2H-pyran-2-one Antibiotic ML 236A ML 236A ML-236A desmethylmonacolin J
kegg.compound:C14183 keggC:C14183	Compactin diol lactone ML-236A
seed.compound:cpd09882 seedM:cpd09882	ML-236A Compactin diol lactone
keggC:M_C14183 seedM:M_cpd09882	secondary/obsolete/fantasy identifier