CHEBI:4381 - Delcosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Delcosine
ChEBI ID CHEBI:4381
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H39NO7
Net Charge 0
Average Mass 453.570
Monoisotopic Mass 453.27265
InChI InChI=1S/C24H39NO7/c1-5-25-10-21(11-30-2)7-6-15(26)23-13-8-12-14(31-3)9-22(28,16(13)17(12)27)24(29,20(23)25)19(32-4)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22-,23+,24-/m1/s1
InChIKey BMZNJVXOLCBDPZ-AXCJZLSHSA-N
SMILES CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)C14
ChEBI Ontology
Outgoing Delcosine (CHEBI:4381) is a diterpenoid (CHEBI:23849)
Synonym Source
Delcosine KEGG COMPOUND
Manual Xrefs Databases
C00001632 KNApSAcK
C08676 KEGG COMPOUND
View more database links
Registry Number Type Source
545-56-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014