Natural Product: NPC477185

Natural Product ID:  NPC477185
Common Name:   Latifolian A
IUPAC Name:  
Synonyms:  
Molecular Formula:   C24H21NO6.C2HF3O2
Standard InCHIKey:  FXTGRMRTLHJIHI-WKYOCQDPSA-N
Standard InCHI:  InChI=1S/C24H21NO6.C2HF3O2/c26-19-5-11-1-2-25-16-10-24(31)21(28)7-13(16)4-18(25)15-9-23(30)20(27)6-12(15)3-17(25)14(11)8-22(19)29;3-2(4,5)1(6)7/h5-10,17-18H,1-4H2,(H5-,26,27,28,29,30,31);(H,6,7)/t17-,18+,25-;/m0./s1
Canonical SMILES:  OC(=O)C(F)(F)F.[O-]c1cc2c(cc1O)C[C@H]1[N+]32CCc2c([C@@H]3Cc3c1cc(c(c3)O)O)cc(c(c2)O)O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO9516 Gnetum latifolium Species Gnetaceae Eukaryota stem bark Veikabu bridge along the Hiritano highway 40 km from Port Moresby, Papua New Guinea 1998-FEB PMID[16038553]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT3207 Individual Protein c-Jun N-terminal kinase 3 Homo sapiens IC50 = 13000 nM 16038553

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC477185 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
0.981 High Similarity NPC477187
0.9281 High Similarity NPC477186
0.7889 Intermediate Similarity NPC320088
0.7877 Intermediate Similarity NPC276674
0.7877 Intermediate Similarity NPC33902
0.7764 Intermediate Similarity NPC323123
0.7725 Intermediate Similarity NPC88249
0.7725 Intermediate Similarity NPC151895
0.7725 Intermediate Similarity NPC220858
0.7725 Intermediate Similarity NPC192768
0.7725 Intermediate Similarity NPC97221
0.7702 Intermediate Similarity NPC211468
0.7702 Intermediate Similarity NPC219233
0.7702 Intermediate Similarity NPC170170
0.7647 Intermediate Similarity NPC249797
0.7647 Intermediate Similarity NPC469817
0.7647 Intermediate Similarity NPC2413
0.7647 Intermediate Similarity NPC110416
0.7647 Intermediate Similarity NPC276588
0.7647 Intermediate Similarity NPC172765
0.7647 Intermediate Similarity NPC39701
0.7647 Intermediate Similarity NPC184026
0.7647 Intermediate Similarity NPC127674
0.7647 Intermediate Similarity NPC189266
0.7647 Intermediate Similarity NPC295691
0.7647 Intermediate Similarity NPC5238
0.7647 Intermediate Similarity NPC193949
0.7647 Intermediate Similarity NPC204828
0.7647 Intermediate Similarity NPC278799
0.7647 Intermediate Similarity NPC207757
0.7647 Intermediate Similarity NPC54379
0.7616 Intermediate Similarity NPC111485
0.7566 Intermediate Similarity NPC127178
0.7554 Intermediate Similarity NPC474904
0.7553 Intermediate Similarity NPC17677
0.7543 Intermediate Similarity NPC238530
0.7543 Intermediate Similarity NPC232514
0.7543 Intermediate Similarity NPC276944
0.7529 Intermediate Similarity NPC24954
0.75 Intermediate Similarity NPC250846
0.75 Intermediate Similarity NPC240841
0.75 Intermediate Similarity NPC186063
0.75 Intermediate Similarity NPC428
0.75 Intermediate Similarity NPC256012
0.75 Intermediate Similarity NPC42549
0.75 Intermediate Similarity NPC268503
0.75 Intermediate Similarity NPC476571
0.75 Intermediate Similarity NPC24233
0.75 Intermediate Similarity NPC147390
0.75 Intermediate Similarity NPC287588
0.75 Intermediate Similarity NPC317272
0.75 Intermediate Similarity NPC135538
0.75 Intermediate Similarity NPC246587
0.7488 Intermediate Similarity NPC214980
0.7486 Intermediate Similarity NPC285941
0.7473 Intermediate Similarity NPC179704
0.7459 Intermediate Similarity NPC190461
0.744 Intermediate Similarity NPC321505
0.744 Intermediate Similarity NPC179825
0.744 Intermediate Similarity NPC191376
0.7371 Intermediate Similarity NPC205167
0.7366 Intermediate Similarity NPC312531
0.7365 Intermediate Similarity NPC125852
0.736 Intermediate Similarity NPC210140
0.7354 Intermediate Similarity NPC162653
0.7353 Intermediate Similarity NPC103379
0.7353 Intermediate Similarity NPC477565
0.7345 Intermediate Similarity NPC284183
0.7345 Intermediate Similarity NPC24465
0.7345 Intermediate Similarity NPC4138
0.7345 Intermediate Similarity NPC121275
0.7344 Intermediate Similarity NPC471489
0.734 Intermediate Similarity NPC78284
0.7337 Intermediate Similarity NPC249405
0.7329 Intermediate Similarity NPC300020
0.7329 Intermediate Similarity NPC302171
0.7329 Intermediate Similarity NPC33338
0.7321 Intermediate Similarity NPC185838
0.7316 Intermediate Similarity NPC161804
0.731 Intermediate Similarity NPC269449
0.7305 Intermediate Similarity NPC136860
0.7305 Intermediate Similarity NPC476567
0.7305 Intermediate Similarity NPC128019
0.7303 Intermediate Similarity NPC264850
0.7303 Intermediate Similarity NPC13916
0.7299 Intermediate Similarity NPC147091
0.7288 Intermediate Similarity NPC324144
0.7273 Intermediate Similarity NPC249274
0.7273 Intermediate Similarity NPC166014
0.7273 Intermediate Similarity NPC27410
0.7247 Intermediate Similarity NPC253043
0.7247 Intermediate Similarity NPC477563
0.7247 Intermediate Similarity NPC212794
0.7247 Intermediate Similarity NPC96603
0.7247 Intermediate Similarity NPC306843
0.7247 Intermediate Similarity NPC196447
0.7247 Intermediate Similarity NPC78222
0.7247 Intermediate Similarity NPC134858
0.7247 Intermediate Similarity NPC136508
0.7247 Intermediate Similarity NPC13504
0.7238 Intermediate Similarity NPC475215
0.7238 Intermediate Similarity NPC108434
0.7235 Intermediate Similarity NPC51957
0.7235 Intermediate Similarity NPC16107
0.7235 Intermediate Similarity NPC476151
0.7235 Intermediate Similarity NPC106295
0.7235 Intermediate Similarity NPC476144
0.7235 Intermediate Similarity NPC210437
0.7225 Intermediate Similarity NPC37272
0.7225 Intermediate Similarity NPC26601
0.7222 Intermediate Similarity NPC66573
0.7193 Intermediate Similarity NPC7467
0.7191 Intermediate Similarity NPC1229
0.7191 Intermediate Similarity NPC233650
0.7182 Intermediate Similarity NPC109925
0.7171 Intermediate Similarity NPC280272
0.7168 Intermediate Similarity NPC76213
0.7168 Intermediate Similarity NPC277669
0.7167 Intermediate Similarity NPC117188
0.7167 Intermediate Similarity NPC205421
0.7167 Intermediate Similarity NPC12053
0.7167 Intermediate Similarity NPC474931
0.7167 Intermediate Similarity NPC306555
0.7167 Intermediate Similarity NPC158376
0.7167 Intermediate Similarity NPC81218
0.7167 Intermediate Similarity NPC145832
0.7158 Intermediate Similarity NPC199465
0.7158 Intermediate Similarity NPC128560
0.7158 Intermediate Similarity NPC229166
0.7158 Intermediate Similarity NPC302001
0.7157 Intermediate Similarity NPC318525
0.7157 Intermediate Similarity NPC10653
0.7151 Intermediate Similarity NPC7715
0.7151 Intermediate Similarity NPC90998
0.7151 Intermediate Similarity NPC279228
0.7151 Intermediate Similarity NPC54654
0.7151 Intermediate Similarity NPC223690
0.7151 Intermediate Similarity NPC229373
0.7151 Intermediate Similarity NPC239824
0.7151 Intermediate Similarity NPC33507
0.7151 Intermediate Similarity NPC328155
0.7151 Intermediate Similarity NPC251735
0.7151 Intermediate Similarity NPC271013
0.7151 Intermediate Similarity NPC181796
0.7151 Intermediate Similarity NPC217748
0.7151 Intermediate Similarity NPC8836
0.7151 Intermediate Similarity NPC182052
0.7151 Intermediate Similarity NPC185639
0.7151 Intermediate Similarity NPC258657
0.7151 Intermediate Similarity NPC15414
0.7151 Intermediate Similarity NPC104196
0.7151 Intermediate Similarity NPC49075
0.7151 Intermediate Similarity NPC42663
0.7151 Intermediate Similarity NPC222661
0.7151 Intermediate Similarity NPC290005
0.7151 Intermediate Similarity NPC311973
0.7151 Intermediate Similarity NPC285931
0.7151 Intermediate Similarity NPC290582
0.715 Intermediate Similarity NPC202605
0.715 Intermediate Similarity NPC119722
0.715 Intermediate Similarity NPC112206
0.715 Intermediate Similarity NPC159815
0.7143 Intermediate Similarity NPC138487
0.7143 Intermediate Similarity NPC216459
0.7143 Intermediate Similarity NPC41178
0.7143 Intermediate Similarity NPC469428
0.7135 Intermediate Similarity NPC60186
0.7134 Intermediate Similarity NPC317872
0.7126 Intermediate Similarity NPC233029
0.7126 Intermediate Similarity NPC82285
0.7126 Intermediate Similarity NPC133011
0.7126 Intermediate Similarity NPC210148
0.7113 Intermediate Similarity NPC25897
0.7112 Intermediate Similarity NPC254441
0.7112 Intermediate Similarity NPC274716
0.7112 Intermediate Similarity NPC167116
0.7102 Intermediate Similarity NPC146288
0.7102 Intermediate Similarity NPC25084
0.7102 Intermediate Similarity NPC247639
0.7102 Intermediate Similarity NPC234392
0.7102 Intermediate Similarity NPC31311
0.7098 Intermediate Similarity NPC23080
0.7098 Intermediate Similarity NPC193906
0.7097 Intermediate Similarity NPC286119
0.7093 Intermediate Similarity NPC130941
0.7088 Intermediate Similarity NPC311991
0.7086 Intermediate Similarity NPC2295
0.7086 Intermediate Similarity NPC477564
0.7083 Intermediate Similarity NPC188163
0.7083 Intermediate Similarity NPC213206
0.7083 Intermediate Similarity NPC474915
0.7083 Intermediate Similarity NPC328750
0.7081 Intermediate Similarity NPC114364
0.7081 Intermediate Similarity NPC320223
0.7072 Intermediate Similarity NPC150879
0.7072 Intermediate Similarity NPC298979
0.7068 Intermediate Similarity NPC24260
0.7062 Intermediate Similarity NPC212163
0.7059 Intermediate Similarity NPC30779
0.7052 Intermediate Similarity NPC207824

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC477185 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.7744 Intermediate Similarity NPD3845 Phase 1
0.7697 Intermediate Similarity NPD2421 Approved
0.7697 Intermediate Similarity NPD2420 Approved
0.764 Intermediate Similarity NPD7479 Phase 2
0.7636 Intermediate Similarity NPD2422 Clinical (unspecified phase)
0.7378 Intermediate Similarity NPD1632 Clinical (unspecified phase)
0.736 Intermediate Similarity NPD3975 Discontinued
0.7235 Intermediate Similarity NPD4584 Approved
0.7151 Intermediate Similarity NPD6344 Clinical (unspecified phase)
0.7151 Intermediate Similarity NPD8054 Approved
0.7151 Intermediate Similarity NPD8053 Approved
0.7143 Intermediate Similarity NPD3784 Discontinued
0.7143 Intermediate Similarity NPD6656 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD4664 Clinical (unspecified phase)
0.7049 Intermediate Similarity NPD4498 Clinical (unspecified phase)
0.7011 Intermediate Similarity NPD5600 Discontinued
0.6995 Remote Similarity NPD5602 Clinical (unspecified phase)
0.6995 Remote Similarity NPD5582 Discontinued
0.6979 Remote Similarity NPD5610 Approved
0.6961 Remote Similarity NPD3984 Clinical (unspecified phase)
0.6961 Remote Similarity NPD3983 Phase 3
0.6952 Remote Similarity NPD5522 Clinical (unspecified phase)
0.695 Remote Similarity NPD5658 Approved
0.6949 Remote Similarity NPD7298 Approved
0.6933 Remote Similarity NPD3595 Approved
0.6933 Remote Similarity NPD3594 Approved
0.6923 Remote Similarity NPD4010 Discontinued
0.69 Remote Similarity NPD7222 Phase 2
0.6895 Remote Similarity NPD4951 Discontinued
0.6894 Remote Similarity NPD6320 Approved
0.6893 Remote Similarity NPD4772 Phase 2
0.6893 Remote Similarity NPD4773 Phase 2
0.689 Remote Similarity NPD5155 Approved
0.689 Remote Similarity NPD5156 Approved
0.6852 Remote Similarity NPD3055 Approved
0.6852 Remote Similarity NPD3053 Approved
0.6848 Remote Similarity NPD2028 Clinical (unspecified phase)
0.6829 Remote Similarity NPD2606 Approved
0.6829 Remote Similarity NPD2605 Approved
0.6821 Remote Similarity NPD3141 Discontinued
0.6816 Remote Similarity NPD6738 Phase 2
0.6816 Remote Similarity NPD6737 Phase 2
0.6815 Remote Similarity NPD313 Approved
0.6813 Remote Similarity NPD6767 Clinical (unspecified phase)
0.6813 Remote Similarity NPD5823 Approved
0.6813 Remote Similarity NPD7201 Clinical (unspecified phase)
0.6811 Remote Similarity NPD7449 Clinical (unspecified phase)
0.6811 Remote Similarity NPD5938 Phase 3
0.6804 Remote Similarity NPD6046 Clinical (unspecified phase)
0.6804 Remote Similarity NPD7262 Phase 1
0.6798 Remote Similarity NPD2789 Approved
0.6778 Remote Similarity NPD5599 Discontinued
0.6774 Remote Similarity NPD8251 Approved
0.6774 Remote Similarity NPD8099 Discontinued
0.6774 Remote Similarity NPD8252 Approved
0.6768 Remote Similarity NPD3636 Approved
0.6768 Remote Similarity NPD3637 Approved
0.6768 Remote Similarity NPD3635 Approved
0.6763 Remote Similarity NPD3301 Approved
0.6758 Remote Similarity NPD4796 Discontinued
0.6757 Remote Similarity NPD6365 Clinical (unspecified phase)
0.6751 Remote Similarity NPD6877 Discontinued
0.6746 Remote Similarity NPD7718 Clinical (unspecified phase)
0.6746 Remote Similarity NPD5070 Clinical (unspecified phase)
0.6742 Remote Similarity NPD3296 Phase 1
0.674 Remote Similarity NPD1743 Approved
0.674 Remote Similarity NPD19 Approved
0.674 Remote Similarity NPD1742 Approved
0.6738 Remote Similarity NPD8156 Discontinued
0.6732 Remote Similarity NPD3815 Phase 1
0.6732 Remote Similarity NPD3816 Phase 1
0.673 Remote Similarity NPD4093 Discontinued
0.6723 Remote Similarity NPD814 Clinical (unspecified phase)
0.6705 Remote Similarity NPD5819 Phase 2
0.6703 Remote Similarity NPD6533 Clinical (unspecified phase)
0.6703 Remote Similarity NPD4083 Discontinued
0.67 Remote Similarity NPD2916 Discontinued
0.6687 Remote Similarity NPD5311 Approved
0.6687 Remote Similarity NPD5310 Approved
0.6685 Remote Similarity NPD4121 Phase 3
0.6685 Remote Similarity NPD4120 Approved
0.6667 Remote Similarity NPD6607 Clinical (unspecified phase)
0.6667 Remote Similarity NPD27 Approved
0.6667 Remote Similarity NPD6030 Approved
0.6667 Remote Similarity NPD3641 Approved
0.6667 Remote Similarity NPD3639 Approved
0.6667 Remote Similarity NPD6031 Approved
0.6667 Remote Similarity NPD2898 Approved
0.6667 Remote Similarity NPD2489 Approved
0.6667 Remote Similarity NPD3640 Phase 3
0.6667 Remote Similarity NPD7889 Clinical (unspecified phase)
0.6651 Remote Similarity NPD8109 Clinical (unspecified phase)
0.665 Remote Similarity NPD7452 Approved
0.665 Remote Similarity NPD7453 Approved
0.6649 Remote Similarity NPD5917 Clinical (unspecified phase)
0.6649 Remote Similarity NPD2843 Phase 2
0.6649 Remote Similarity NPD2845 Phase 2
0.6648 Remote Similarity NPD5741 Approved
0.6648 Remote Similarity NPD5743 Approved
0.6648 Remote Similarity NPD5742 Approved
0.6636 Remote Similarity NPD7025 Clinical (unspecified phase)
0.6636 Remote Similarity NPD6494 Phase 2
0.6633 Remote Similarity NPD5575 Clinical (unspecified phase)
0.6632 Remote Similarity NPD7149 Clinical (unspecified phase)
0.663 Remote Similarity NPD6283 Phase 2
0.663 Remote Similarity NPD6818 Clinical (unspecified phase)
0.6628 Remote Similarity NPD4725 Approved
0.6628 Remote Similarity NPD4721 Approved
0.6628 Remote Similarity NPD4726 Approved
0.6615 Remote Similarity NPD5641 Discontinued
0.6614 Remote Similarity NPD3920 Phase 2
0.6612 Remote Similarity NPD7831 Phase 2
0.6612 Remote Similarity NPD7833 Phase 2
0.6612 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6611 Remote Similarity NPD2468 Approved
0.6611 Remote Similarity NPD2469 Approved
0.6601 Remote Similarity NPD7174 Clinical (unspecified phase)
0.66 Remote Similarity NPD7255 Clinical (unspecified phase)
0.6599 Remote Similarity NPD6493 Phase 3
0.6592 Remote Similarity NPD6357 Discontinued
0.6592 Remote Similarity NPD4017 Approved
0.6592 Remote Similarity NPD3229 Phase 2
0.6588 Remote Similarity NPD817 Approved
0.6588 Remote Similarity NPD823 Approved
0.6582 Remote Similarity NPD3924 Approved
0.6582 Remote Similarity NPD3922 Approved
0.6582 Remote Similarity NPD3921 Approved
0.6582 Remote Similarity NPD3923 Approved
0.6571 Remote Similarity NPD5241 Discontinued
0.6562 Remote Similarity NPD7877 Suspended
0.6561 Remote Similarity NPD6159 Phase 2
0.6559 Remote Similarity NPD3051 Approved
0.6554 Remote Similarity NPD5881 Clinical (unspecified phase)
0.6552 Remote Similarity NPD4430 Phase 2
0.655 Remote Similarity NPD5609 Approved
0.655 Remote Similarity NPD5608 Approved
0.655 Remote Similarity NPD3837 Clinical (unspecified phase)
0.6541 Remote Similarity NPD6037 Discontinued
0.654 Remote Similarity NPD2899 Discontinued
0.6535 Remote Similarity NPD956 Clinical (unspecified phase)
0.6533 Remote Similarity NPD7034 Discontinued
0.6533 Remote Similarity NPD7948 Phase 1
0.6524 Remote Similarity NPD2969 Approved
0.6524 Remote Similarity NPD2970 Approved
0.652 Remote Similarity NPD5530 Phase 1
0.6515 Remote Similarity NPD4418 Discontinued
0.6515 Remote Similarity NPD6861 Clinical (unspecified phase)
0.6514 Remote Similarity NPD6506 Clinical (unspecified phase)
0.6513 Remote Similarity NPD7906 Approved
0.651 Remote Similarity NPD6461 Clinical (unspecified phase)
0.651 Remote Similarity NPD8453 Clinical (unspecified phase)
0.6497 Remote Similarity NPD3634 Approved
0.6497 Remote Similarity NPD3633 Approved
0.6492 Remote Similarity NPD6496 Clinical (unspecified phase)
0.649 Remote Similarity NPD7301 Phase 3
0.6484 Remote Similarity NPD6723 Discontinued
0.648 Remote Similarity NPD5928 Phase 1
0.6477 Remote Similarity NPD4577 Approved
0.6477 Remote Similarity NPD7312 Approved
0.6477 Remote Similarity NPD7310 Approved
0.6477 Remote Similarity NPD7313 Approved
0.6477 Remote Similarity NPD7311 Approved
0.6477 Remote Similarity NPD4578 Approved
0.6476 Remote Similarity NPD8149 Discontinued
0.6476 Remote Similarity NPD7112 Discontinued
0.6471 Remote Similarity NPD1293 Approved
0.6471 Remote Similarity NPD3059 Approved
0.6471 Remote Similarity NPD3061 Approved
0.6471 Remote Similarity NPD4166 Phase 2
0.6471 Remote Similarity NPD3062 Approved
0.6464 Remote Similarity NPD5617 Suspended
0.6462 Remote Similarity NPD4663 Approved
0.6461 Remote Similarity NPD3645 Discontinued
0.6461 Remote Similarity NPD1754 Clinical (unspecified phase)
0.646 Remote Similarity NPD2226 Clinical (unspecified phase)
0.6453 Remote Similarity NPD6636 Phase 3
0.645 Remote Similarity NPD7238 Clinical (unspecified phase)
0.645 Remote Similarity NPD6284 Clinical (unspecified phase)
0.6448 Remote Similarity NPD6060 Clinical (unspecified phase)
0.6447 Remote Similarity NPD6503 Clinical (unspecified phase)
0.6446 Remote Similarity NPD4103 Phase 2
0.6446 Remote Similarity NPD4104 Clinical (unspecified phase)
0.6443 Remote Similarity NPD7309 Approved
0.644 Remote Similarity NPD5900 Clinical (unspecified phase)
0.6436 Remote Similarity NPD5680 Clinical (unspecified phase)
0.6436 Remote Similarity NPD6612 Phase 2
0.6433 Remote Similarity NPD308 Approved
0.6432 Remote Similarity NPD7858 Clinical (unspecified phase)
0.6418 Remote Similarity NPD5071 Phase 2
0.6417 Remote Similarity NPD6457 Approved
0.6417 Remote Similarity NPD4986 Clinical (unspecified phase)
0.6417 Remote Similarity NPD6107 Approved
0.6416 Remote Similarity NPD1753 Discontinued
0.6414 Remote Similarity NPD5587 Approved
0.6414 Remote Similarity NPD5937 Approved
0.6413 Remote Similarity NPD6524 Clinical (unspecified phase)
0.6406 Remote Similarity NPD6211 Clinical (unspecified phase)
0.6404 Remote Similarity NPD3124 Discontinued
0.64 Remote Similarity NPD4256 Phase 2
0.64 Remote Similarity NPD4257 Approved

Structure

External Identifiers

PubChem CID   11478147
ChEMBL   CHEMBL558210
ZINC  

Physicochemical Properties

Molecular Weight:  419.14
ALogP:  -4.2483
MLogP:  3.33
XLogP:  1.848
# Rotatable Bonds:  6
Polar Surface Area:  124.21
# H-Bond Aceptor:  0
# H-Bond Donor:  5
# Rings:  6
# Heavy Atoms:  31

Download Data

Data Type Select
General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs