General Information of the Compound
| Compound ID |
CP0580109
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| Compound Name |
(7R,11S)-8-ethyl-3-methoxy-7,11-dimethylspiro[17-oxa-5,8,10,20,23,25-hexazatetracyclo[16.6.1.12,6.019,23]hexacosa-1(24),2(26),3,5,18(25),19,21-heptaene-15,4'-oxane]-9-one
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| Structure |
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| Formula |
C28H38N6O4
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| Molecular Weight |
522.65
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| Canonical SMILES |
CCN1[C@H](C)c2cc(c(OC)cn2)-c2cn3ccnc3c(OCC3(CCOCC3)CCC[C@H](C)NC1=O)n2
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| InChI |
InChI=1S/C28H38N6O4/c1-5-34-20(3)22-15-21(24(36-4)16-30-22)23-17-33-12-11-29-25(33)26(32-23)38-18-28(9-13-37-14-10-28)8-6-7-19(2)31-27(34)35/h11-12,15-17,19-20H,5-10,13-14,18H2,1-4H3,(H,31,35)/t19-,20+/m0/s1
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| InChIKey |
FZKCBXJFSVPJLC-VQTJNVASSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound