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(9Z)-12,13,17-trihydroxyoctadeca-9-enoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM13982

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

formula

C₁₈H₃₃O₅

charge

-1

mass

329.23335

reference

InChIKey

IYIVYYHFHGVWRB-VURMDHGXSA-M

InChI

InChI=1S/C18H34O5/c1-15(19)11-10-13-17(21)16(20)12-8-6-4-2-3-5-7-9-14-18(22)23/h6,8,15-17,19-21H,2-5,7,9-14H2,1H3,(H,22,23)/p-1/b8-6-

SMILES

CC(O)CCCC(O)C(O)C/C=C\CCCCCCCC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-13087 metacycM:CPD-13087	(9Z)-12,13,17-trihydroxyoctadeca-9-enoate (9Z)-12,13,17-trihydroxyoctadeca-9-enoic acid
seed.compound:cpd23728 seedM:cpd23728	12,13,17-trihydroxyoctadeca-9-enoate (9Z)-12,13,17-trihydroxyoctadeca-9-enoate (9Z)-12,13,17-trihydroxyoctadeca-9-enoic acid 12,13,17-trihydroxyoctadeca-9-enoic acid
seedM:M_cpd23728	secondary/obsolete/fantasy identifier