CHEBI:9243 - Sporidesmin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Sporidesmin
ChEBI ID CHEBI:9243
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H20ClN3O6S2
Net Charge 0
Average Mass 473.954
Monoisotopic Mass 473.048
InChI InChI=1S/C18H20ClN3O6S2/c1-16-14(24)22-13-17(26,12(23)18(22,30-29-16)15(25)21(16)3)7-6-8(19)10(27-4)11(28-5)9(7)20(13)2/h6,12-13,23,26H,1-5H3/t12-,13-,16-,17-,18-/m1/s1
InChIKey QTONANGUNATZOU-ICTVWZTPSA-N
SMILES COc1c2N(C)[C@@H]3N4C(=O)[C@@]5(C)SS[C@]4([C@H](O)[C@]3(O)c2cc(Cl)c1OC)C(=O)N5C
ChEBI Ontology
Outgoing Sporidesmin (CHEBI:9243) is a pyrroloindole (CHEBI:48133)
Synonym Source
Sporidesmin KEGG COMPOUND
Manual Xrefs Databases
C00002363 KNApSAcK
C10618 KEGG COMPOUND
View more database links
Registry Number Type Source
1456-55-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014