NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a a
CompoundLongimicins C
NPACT-IdNPACT00723
IUPAC(2S)-4-[(2R,7R)-2,7-dihydroxy-7-[(2R,5R)-5-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]oxolan-2-yl]heptyl]-2-methyl-2H-furan-5-one
Synonyms-
PubChem Id10483634
ClassPolyketides
In-vitro anticancer activtiy 6 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyHEAQKFJRNIADPO-GHRGOOLJSA-N
InChi1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-29(37)31-20-22-33(41-31)34-23-21-32(42-34)30(38)19-16-15-17-28(36)25-27-24-26(2)40-35(27)39/h24,26,28-34,36-38H,3-23,25H2,1-2H3/t26-,28+,29+,30+,31+,32+,33+,34+/m0/s1
SMILESO1[C@@H]([C@@H]2O[C@H](CC2)[C@H](O)CCCC[C@@H](O)CC2=C[C@@H](OC2=O)C)CC[C@@H]1[C@H](O)CCCCCCCCCCCCCC
SMART[#6]CCCCCCCCCCCCC[C@@H](O)[C@H]1CC[C@@H](O1)[C@H]1CC[C@@H](O1)[C@H](O)CCCC[C@@H](O)CC1=C[C@H]([#6])OC1=O
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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