Terminology Service for NFDI4Health
Grahamine D, (rel)-
Go to external page
http://purl.obolibrary.org/obo/CHEBI_68893
Term info
Label
Grahamine D, (rel)-
Subsets
2_STAR
charge
0
formula
C43H59N3O10
has obo namespace
chebi_ontology
has related synonym
rel-1,2-bis{[(3alpha-hydroxytropo-6beta-yl)oxy]carbonyl}-2-methyl-3-{[((6beta-angeloyloxy)-3alpha-yl)oxy]carbonyl}-4-phenylcyclobutanecarboxylate
id
CHEBI:68893
inchi
InChI=1S/C43H59N3O10/c1-7-22(2)39(49)54-34-18-26-15-29(21-32(34)46(26)6)53-40(50)37-36(23-11-9-8-10-12-23)38(41(51)55-33-16-24-13-27(47)19-30(33)44(24)4)43(37,3)42(52)56-35-17-25-14-28(48)20-31(35)45(25)5/h7-12,24-38,47-48H,13-21H2,1-6H3/b22-7-/t24-,25-,26-,27+,28+,29-,30+,31+,32+,33+,34+,35+,36?,37?,38?,43?/m0/s1
inchikey
BAWQSJNAIYVRIL-DGXFYYPGSA-N
mass
777.94270
monoisotopicmass
777.42005
smiles
[H][C@]12C[C@@H](O)C[C@]([H])([C@@H](C1)OC(=O)C1C(C(C(=O)O[C@H]3C[C@@]4([H])C[C@@H](OC(=O)C(\C)=C/C)[C@@]([H])(C3)N4C)C1(C)C(=O)O[C@@H]1C[C@]3([H])C[C@@H](O)C[C@@]1([H])N3C)c1ccccc1)N2C
Term relations
Subclass of: