General Information of This Payload
Payload ID
PAY0JYRBE
Name
Chlorin e6 (Ce6)
Synonyms
Chlorin e6 (Ce6)
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Formula
C34H36N4O6
Isosmiles
CC1=C(C(/C(CC(O)=O)=C2C(C(C(/C=C(N/3)/C(C)=C(C=C)C3=C\C4=C5C)=N/2)C)CCC(O)=O)=N/C1=C\C(N4)=C5CC)C(O)=O
InChI
InChI=1S/C34H36N4O6/c1-7-19-15(3)23-12-25-17(5)21(9-10-29(39)40)32(37-25)22(11-30(41)42)33-31(34(43)44)18(6)26(38-33)14-28-20(8-2)16(4)24(36-28)13-27(19)35-23/h7,12-14,17,21,35-36H,1,8-11H2,2-6H3,(H,39,40)(H,41,42)(H,43,44)
InChIKey
OYINILBBZAQBEV-UHFFFAOYSA-N
Pharmaceutical Properties
Molecule Weight
596.684
Polar area
169.26
Complexity
1900.660674
xlogp Value
6.53154
Heavy Count
44
Rot Bonds
8
Hbond acc
5
Hbond Donor
5
Each Antibody-drug Conjugate Related to This Payload