CHEBI:6430 - Leurosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Leurosine
ChEBI ID CHEBI:6430
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C46H56N4O9
Net Charge 0
Average Mass 808.960
Monoisotopic Mass 808.40473
InChI InChI=1S/C46H56N4O9/c1-8-42-16-12-18-50-20-17-44(37(42)50)30-21-31(34(55-5)22-33(30)48(4)38(44)46(54,41(53)57-7)39(42)58-26(3)51)45(40(52)56-6)23-27-24-49(25-43(9-2)36(27)59-43)19-15-29-28-13-10-11-14-32(28)47-35(29)45/h10-14,16,21-22,27,36-39,47,54H,8-9,15,17-20,23-25H2,1-7H3/t27-,36-,37+,38-,39-,42-,43+,44-,45+,46+/m1/s1
InChIKey LPGWZGMPDKDHEP-HLTPFJCJSA-N
SMILES CC[C@]12C[N@@]3C[C@@H](C[C@@](C(=O)OC)(c4[nH]c5ccccc5c4CC3)c3cc4c(cc3OC)N(C)[C@@H]3[C@]44CCN5CC=C[C@](CC)([C@@H]45)[C@@H](OC(C)=O)[C@]3(O)C(=O)OC)[C@H]1O2
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.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Leurosine (CHEBI:6430) is a vinca alkaloid (CHEBI:27288)
Synonyms Sources
Leurosine KEGG COMPOUND
Vinleurosine KEGG COMPOUND
Manual Xrefs Databases
C00001744 KNApSAcK
C09219 KEGG COMPOUND
View more database links
Registry Number Type Source
23360-92-1 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014