CHEBI:32956 - epoxytwinol A

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ChEBI Name epoxytwinol A
ChEBI ID CHEBI:32956
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H20O8
Net Charge 0
Average Mass 388.36800
Monoisotopic Mass 388.11582
InChI InChI=1S/C20H20O8/c1-3-5-6-4(2)26-16(10-8(6)12(22)18-20(28-18)14(10)24)15(25-3)9-7(5)11(21)17-19(27-17)13(9)23/h3-6,13-20,23-24H,1-2H3/t3-,4-,5+,6+,13+,14+,15+,16+,17+,18+,19-,20-/m1/s1
InChIKey ISNQEMOAOOBDGE-ZMUZJQFCSA-N
SMILES C[C@H]1O[C@@H]2[C@H]3O[C@H](C)[C@@H]([C@H]1C1=C2[C@H](O)[C@H]2O[C@H]2C1=O)C1=C3[C@H](O)[C@H]2O[C@H]2C1=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): angiogenesis inhibitor
An agent and endogenous substances that antagonize or inhibit the development of new blood vessels.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing epoxytwinol A (CHEBI:32956) has role angiogenesis inhibitor (CHEBI:48422)
epoxytwinol A (CHEBI:32956) has role metabolite (CHEBI:25212)
epoxytwinol A (CHEBI:32956) is a pentaketide (CHEBI:50529)
IUPAC Name
(1S,2S,4S,5R,7R,10S,11S,14R,16R,17S,20R,21R)-4,17-dihydroxy-20,21-dimethyl-6,15,19,22-tetraoxaheptacyclo[9.7.2.22,10.03,9.05,7.012,18.014,16]docosa-3(9),12(18)-diene-8,13-dione
Last Modified
06 August 2014
General Comment
2008-09-02 A pentaketide dimer.