CHEBI:3581 - Chasmanthin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Chasmanthin
ChEBI ID CHEBI:3581
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000004097885
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Formula C20H22O7
Net Charge 0
Average Mass 374.385
Monoisotopic Mass 374.13655
InChI InChI=1S/C20H22O7/c1-18-7-11(9-4-6-24-8-9)25-16(21)10(18)3-5-19(2)14(18)12-13-15(26-13)20(19,23)17(22)27-12/h4,6,8,10-15,23H,3,5,7H2,1-2H3/t10-,11+,12+,13-,14-,15-,18+,19+,20-/m0/s1
InChIKey TXOMRNMZLZXJQP-OQDMGONLSA-N
SMILES C[C@@]12C[C@@H](OC(=O)[C@@H]1CC[C@]1(C)[C@H]2[C@@H]2OC(=O)[C@@]1(O)[C@H]1O[C@@H]21)c1ccoc1
ChEBI Ontology
Outgoing Chasmanthin (CHEBI:3581) is a organic heterotricyclic compound (CHEBI:26979)
Chasmanthin (CHEBI:3581) is a organooxygen compound (CHEBI:36963)
Synonym Source
Chasmanthin KEGG COMPOUND
Manual Xrefs Databases
C00003413 KNApSAcK
C09073 KEGG COMPOUND
View more database links
Registry Number Type Source
20379-19-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014