Preferred Name | APC | |
Synonyms |
|
|
ID |
http://purl.obolibrary.org/obo/CHEBI_80551 |
|
charge |
0 |
|
database_cross_reference |
KEGG:C16542 HMDB:HMDB0060661 |
|
formula |
C33H38N4O8 |
|
has_obo_namespace |
chebi_ontology |
|
id |
CHEBI:80551 |
|
in_subset | ||
inchi |
InChI=1S/C33H38N4O8/c1-3-21-22-15-20(45-32(42)36-13-10-19(11-14-36)34-12-6-5-7-28(38)39)8-9-26(22)35-29-23(21)17-37-27(29)16-25-24(30(37)40)18-44-31(41)33(25,43)4-2/h8-9,15-16,19,34,43H,3-7,10-14,17-18H2,1-2H3,(H,38,39)/t33-/m0/s1 |
|
inchikey |
BSVVZICJFYZDJJ-XIFFEERXSA-N |
|
label |
APC |
|
mass |
618.67680 |
|
monoisotopicmass |
618.26896 |
|
notation |
CHEBI:80551 |
|
prefLabel |
APC |
|
smiles |
CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)NCCCCC(O)=O)cc12 |
|
subClassOf |
Create mapping