Navigation

name Structure Reference Source Properties Activities Metabolism

Pyridomycin

AlkaPlorer ID: AK311903

Synonym: 3-Hydroxy-N-[10-hydroxy-5,11-dimethyl-2-(1-methylpropylidene)-3,7,12-trioxo-9-(3-pyridylmethyl)-1,4-dioxa-8-azacyclododec-6-yl]-2-pyridinecarboxamide, U 24544, Antibiotic U 24544, Erizomycin 

IUPAC Name: N-[(2Z)-2-butan-2-ylidene-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-9-(pyridin-3-ylmethyl)-1,4-dioxa-8-azacyclododec-6-yl]-3-hydroxypyridine-2-carboxamide

Structure

SMILES: CC/C(C)=C1\OC(=O)C(C)C(O)C(CC2=CC=CN=C2)N=C(O)C(N=C(O)C2=NC=CC=C2O)C(C)OC1=O

copy

InChI: InChI=1S/C27H32N4O8/c1-5-14(2)23-27(37)38-16(4)20(31-25(35)21-19(32)9-7-11-29-21)24(34)30-18(12-17-8-6-10-28-13-17)22(33)15(3)26(36)39-23/h6-11,13,15-16,18,20,22,32-33H,5,12H2,1-4H3,(H,30,34)(H,31,35)/b23-14-

copy

InChIKey: WHIKSLGSXKIHCA-UCQKPKSFSA-N

copy

Properties Information

Molecule Weight: 540.5730000000001

TPSA？: 184.02

MolLogP？: 2.5927000000000007

Number of H-Donors: 4

Number of H-Acceptors: 10

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens 786-0 GI50 100000.0 nM None
Homo sapiens A498 GI50 100000.0 nM None
Homo sapiens A549 GI50 74301.91 nM None
Homo sapiens ACHN GI50 6698.85 nM None
Homo sapiens BT-549 GI50 100000.0 nM None
Homo sapiens CAKI-1 GI50 100000.0 nM None
Homo sapiens COLO 205 GI50 100000.0 nM None
Homo sapiens DU-145 GI50 100000.0 nM None
Homo sapiens EKVX GI50 31260.79 nM None
Homo sapiens HCC 2998 GI50 100000.0 nM None
Homo sapiens HCT-116 GI50 82224.26 nM None
Homo sapiens HCT-15 GI50 49545.02 nM None
Homo sapiens HL-60 GI50 62805.84 nM None
Homo sapiens HOP-62 GI50 51050.5 nM None
Homo sapiens Hs-578T GI50 29716.66 nM None
Homo sapiens HT-29 GI50 42169.65 nM None
Homo sapiens IGROV-1 GI50 27101.92 nM None
Homo sapiens K562 GI50 100000.0 nM None
Homo sapiens KM12 GI50 41975.9 nM None
Homo sapiens LOX IMVI GI50 100000.0 nM None
Homo sapiens M14 GI50 70631.76 nM None
Homo sapiens Malme-3M GI50 39536.66 nM None
Homo sapiens MCF7 GI50 100000.0 nM None
Homo sapiens MDA-MB-231 GI50 100000.0 nM None
Homo sapiens MDA-MB-435 GI50 100000.0 nM None
Homo sapiens MDA-N GI50 100000.0 nM None
Homo sapiens MOLT-4 GI50 53579.67 nM None
Homo sapiens NCI-H23 GI50 100000.0 nM None
Homo sapiens NCI-H322M GI50 50699.07 nM None
Homo sapiens NCI-H460 GI50 63095.73 nM None
Homo sapiens OVCAR-3 GI50 100000.0 nM None
Homo sapiens OVCAR-4 GI50 100000.0 nM None
Homo sapiens OVCAR-5 GI50 100000.0 nM None
Homo sapiens OVCAR-8 GI50 63826.35 nM None
Homo sapiens PC-3 GI50 50003.45 nM None
Homo sapiens RPMI-8226 GI50 90782.05 nM None
Homo sapiens SF-268 GI50 58344.51 nM None
Homo sapiens SF-295 GI50 44360.86 nM None
Homo sapiens SF-539 GI50 100000.0 nM None
Homo sapiens SK-MEL-2 GI50 100000.0 nM None
Homo sapiens SK-MEL-28 GI50 100000.0 nM None
Homo sapiens SK-MEL-5 GI50 100000.0 nM None
Homo sapiens SK-OV-3 GI50 71944.9 nM None
Homo sapiens SN12C GI50 93972.33 nM None
Homo sapiens SNB-19 GI50 100000.0 nM None
Homo sapiens SNB-75 GI50 51641.64 nM None
Homo sapiens SR GI50 100000.0 nM None
Homo sapiens SW-620 GI50 100000.0 nM None
Homo sapiens T47D GI50 100000.0 nM None
Homo sapiens TK-10 GI50 100000.0 nM None
Homo sapiens U-251 GI50 100000.0 nM None
Homo sapiens UACC-257 GI50 100000.0 nM None
Homo sapiens UACC-62 GI50 100000.0 nM None

Metabolism Information