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Dimethyl ent-16alpha-kaurane-17,19-dioate

Properties

Image

Occurences in reactions

MNX_ID

MNXM124982

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

formula

C₂₂H₃₄O₄

charge

mass

362.24571

reference

InChIKey

USASLHCCADYMNF-UHFFFAOYSA-N

InChI

InChI=1S/C22H34O4/c1-20-9-5-10-21(2,19(24)26-4)16(20)8-11-22-12-14(6-7-17(20)22)15(13-22)18(23)25-3/h14-17H,5-13H2,1-4H3

SMILES

COC(=O)C1CC23CCC4C(C)(C(=O)OC)CCCC4(C)C2CCC1C3

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:174851 chebi:174851	Dimethyl ent-16alpha-kaurane-17,19-dioate dimethyl 5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5,14-dicarboxylate
hmdb:HMDB0036315	Dimethyl ent-16alpha-kaurane-17,19-dioate 5,14-Dimethyl 5,9-dimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5,14-dicarboxylic acid 5,14-dimethyl 5,9-dimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5,14-dicarboxylate Dimethyl ent-16a-kaurane-17,19-dioate Dimethyl ent-16a-kaurane-17,19-dioic acid Dimethyl ent-16alpha-kaurane-17,19-dioic acid
hmdb:HMDB36315	secondary/obsolete/fantasy identifier