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cis-Reticulatacin-10-one

Properties

Image

Occurences in reactions

MNX_ID

MNXM120617

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

formula

C₃₇H₆₆O₆

charge

mass

606.48594

reference

chebi:176214

InChIKey

NZGIKHMTWDNXAF-UHFFFAOYSA-N

InChI

InChI=1S/C37H66O6/c1-3-4-5-6-7-8-9-10-14-20-25-33(39)35-27-28-36(43-35)34(40)26-21-16-15-19-24-32(38)23-18-13-11-12-17-22-31-29-30(2)42-37(31)41/h29-30,33-36,39-40H,3-28H2,1-2H3

SMILES

CCCCCCCCCCCCC(O)C1CCC(C(O)CCCCCCC(=O)CCCCCCCC2=CC(C)OC2=O)O1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:176214 chebi:176214	cis-Reticulatacin-10-one 4-[15-hydroxy-15-[5-(1-hydroxytridecyl)oxolan-2-yl]-8-oxopentadecyl]-2-methyl-2H-uran-5-one
hmdb:HMDB0034967	cis-Reticulatacin-10-one 3-{15-hydroxy-15-[5-(1-hydroxytridecyl)oxolan-2-yl]-8-oxopentadecyl}-5-methyl-2,5-dihydrofuran-2-one 3-{15-hydroxy-15-[5-(1-hydroxytridecyl)oxolan-2-yl]-8-oxopentadecyl}-5-methyl-5H-furan-2-one
hmdb:HMDB34967	secondary/obsolete/fantasy identifier