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taxusin

Properties

Image

Occurences in reactions

MNX_ID

MNXM5939

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

formula

C₂₈H₄₀O₈

charge

mass

504.27232

reference

chebi:63664

InChIKey

SKJSIVQEPKBFTJ-HUWILPJBSA-N

InChI

InChI=1S/C28H40O8/c1-14-21-12-20-13-23(34-17(4)30)15(2)24(27(20,7)8)25(35-18(5)31)26(36-19(6)32)28(21,9)11-10-22(14)33-16(3)29/h20-23,25-26H,1,10-13H2,2-9H3/t20-,21-,22+,23+,25-,26+,28-/m1/s1

SMILES

C=C1[C@@H](OC(C)=O)CC[C@]2(C)[C@@H]1C[C@@H]1C[C@H](OC(C)=O)C(C)=C([C@@H](OC(C)=O)[C@@H]2OC(C)=O)C1(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:63664 chebi:63664	taxusin (+)-taxusin (5alpha,9alpha,10beta,13alpha)-taxa-4(20),11-diene-5,9,10,13-tetrayl tetraacetate taxa-4(20),11-diene-5alpha,9alpha,10beta,13alpha-tetrayl tetraacetate
kegg.compound:C20152 keggC:C20152	Taxusin Taxa-4(20),11-diene-5alpha,9alpha,10beta,13alpha-tetrayl tetraacetate
seed.compound:cpd21385 seedM:cpd21385	Taxusin Taxa-4(20),11-diene-5alpha,9alpha,10beta,13alpha-tetrayl tetraacetate taxa-4(20),11-diene-5alpha,9alpha,10beta,13alpha-tetrayl tetraacetate taxusin
metacyc.compound:CPD-13925 metacycM:CPD-13925	taxusin taxa-4(20),11-diene-5alpha,9alpha,10beta,13alpha-tetrayl tetraacetate
keggC:M_C20152 seedM:M_cpd21385	secondary/obsolete/fantasy identifier