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Name:K1639_SIGMA
PubChem ID:3035817
Pathway:Show KEGG pathways
InChI:InChI=1/C27H21N3O5/c1-26-27(33,25(32)34-2)11-18(35-26)29-16-9-5-3-7-13(16)20-21-15(12-28-24(21)31)19-14-8-4-6-10-17(14)30(26)23(19)22(20)29/h3-10,18,33H,11-12H2,1-2H3,(H,28,31)/t18-,26+,27+/m1/s1/f/h28H
SMILES:C[C@]12[C@](C[C@@H](n3c4ccccc4c4c5c(CNC5=O)c5c6ccccc6n1c5c34)O2)(C(=O)OC)O

Properties:
Formula:C27H21N3O5Atoms:36
Molecular Weight:467.473Rotatable Bonds:2
H-bond Acceptors:6H-bond Donors:0
logP:3.9839
Targets:
Synonyms:
05288_FLUKA
1r0p
3f69
AmbotzLS-1034
CHEMBL281948
DB02152
K-252A
K1639_SIGMA
KSA
MolPort-003-848-298
ZINC03872984