massadine
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http://purl.obolibrary.org/obo/CHEBI_73199
An alkaloid isolated from Stylissa massa.
Term info
Label
massadine
Subsets
3_STAR
charge
0
formula
C22H24Br4N10O5
has obo namespace
chebi_ontology
id
CHEBI:73199
inchi
InChI=1S/C22H24Br4N10O5/c23-7-1-9(31-13(7)25)15(38)29-3-5-6(4-30-16(39)10-2-8(24)14(26)32-10)12(37)21-11(5)22(40)18(34-20(28)36-22)41-17(21)33-19(27)35-21/h1-2,5-6,11-12,17-18,31-32,37,40H,3-4H2,(H,29,38)(H,30,39)(H3,27,33,35)(H3,28,34,36)/t5-,6-,11+,12+,17+,18-,21+,22-/m1/s1
inchikey
MJHZRZBAUGHJOJ-RVJSRHHYSA-N
mass
828.10600
monoisotopicmass
823.86647
smiles
[H][C@]12NC(=N)N[C@@]1(O)[C@@]1([H])[C@H](CNC(=O)c3cc(Br)c(Br)[nH]3)[C@@H](CNC(=O)c3cc(Br)c(Br)[nH]3)[C@H](O)[C@@]11NC(=N)N[C@@]1([H])O2
Term relations
Subclass of:
- alkaloid
- guanidines
- pyrrolecarboxamide
- organobromine compound
- has role some EC 2.5.1.59 (protein geranylgeranyltransferase type I) inhibitor
- is conjugate base of some massadine(2+)
- has role some animal metabolite
- has role some marine metabolite
Related from: