Natural Product: NPC189206

Natural Product ID:  NPC189206
Common Name:   Atractylenolide Ii
IUPAC Name:   (4aS,8aR,9aS)-3,8a-dimethyl-5-methylidene-4a,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-2-one
Synonyms:   Atractylenolide II
Molecular Formula:   C15H20O2
Standard InCHIKey:  OQYBLUDOOFOBPO-KCQAQPDRSA-N
Standard InCHI:  InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h12-13H,1,4-8H2,2-3H3/t12-,13-,15+/m0/s1
Canonical SMILES:  C=C1CCC[C@]2([C@H]1CC1=C(C)C(=O)O[C@H]1C2)C
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
NPO16087 Atractylodes lancea Species Asteraceae Eukaryota PMID[9544564]
NPO489 Codonopsis radix Species Campanulaceae Eukaryota TCMSP*
NPO22562 Atractylodes macrocephala koidz Species Asteraceae Eukaryota TCMSP*
NPO16087 Atractylodes lancea Species Asteraceae Eukaryota TCMSP*
NPO14204 Herba sarcandrae NA NA NA TCMSP*
NPO12584 Atractylodes chinensis Species Asteraceae Eukaryota TM-MC*
NPO16087 Atractylodes lancea Species Asteraceae Eukaryota TM-MC*
NPO20902 Atractylodes macrocephala Species Asteraceae Eukaryota TM-MC*
NPO16741 Codonopsis pilosula Species Campanulaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1135 Cell Line Hepatocyte Rattus norvegicus Activity = 74 % 6418860
NPT1135 Cell Line Hepatocyte Rattus norvegicus Activity = 94 % 6418860
NPT570 Individual Protein Arachidonate 5-lipoxygenase Homo sapiens IC50 > 200000 nM 9544564
NPT30 Individual Protein Cyclooxygenase-1 Homo sapiens IC50 > 200000 nM 9544564
NPT540 Individual Protein Bile acid receptor FXR Homo sapiens FC = 2 22365756
NPT540 Individual Protein Bile acid receptor FXR Homo sapiens FC = 1.5 22365756
NPT540 Individual Protein Bile acid receptor FXR Homo sapiens Inhibition = 50 % 22365756

  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 NPC189206 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
0.9079 High Similarity NPC268827
0.9067 High Similarity NPC184737
0.8861 High Similarity NPC96055
0.8831 High Similarity NPC10636
0.8765 High Similarity NPC473891
0.875 High Similarity NPC474013
0.8642 High Similarity NPC131813
0.8625 High Similarity NPC32223
0.8608 High Similarity NPC471218
0.85 High Similarity NPC311070
0.8452 Intermediate Similarity NPC221111
0.8452 Intermediate Similarity NPC310479
0.8452 Intermediate Similarity NPC280149
0.8452 Intermediate Similarity NPC182136
0.8442 Intermediate Similarity NPC54996
0.8434 Intermediate Similarity NPC93411
0.8395 Intermediate Similarity NPC30486
0.8375 Intermediate Similarity NPC200513
0.8354 Intermediate Similarity NPC469802
0.8333 Intermediate Similarity NPC50488
0.8333 Intermediate Similarity NPC474396
0.8272 Intermediate Similarity NPC474193
0.8272 Intermediate Similarity NPC12283
0.8256 Intermediate Similarity NPC139692
0.8256 Intermediate Similarity NPC152778
0.8256 Intermediate Similarity NPC205034
0.8256 Intermediate Similarity NPC162615
0.825 Intermediate Similarity NPC170303
0.8235 Intermediate Similarity NPC8062
0.8235 Intermediate Similarity NPC78973
0.8205 Intermediate Similarity NPC316500
0.8193 Intermediate Similarity NPC329692
0.814 Intermediate Similarity NPC472811
0.814 Intermediate Similarity NPC329842
0.814 Intermediate Similarity NPC72845
0.8072 Intermediate Similarity NPC189311
0.8072 Intermediate Similarity NPC65661
0.8072 Intermediate Similarity NPC30984
0.8072 Intermediate Similarity NPC86316
0.8072 Intermediate Similarity NPC106416
0.8049 Intermediate Similarity NPC193198
0.8049 Intermediate Similarity NPC30502
0.8049 Intermediate Similarity NPC321385
0.8046 Intermediate Similarity NPC7349
0.8046 Intermediate Similarity NPC53555
0.8046 Intermediate Similarity NPC472812
0.8025 Intermediate Similarity NPC282293
0.8023 Intermediate Similarity NPC472642
0.8 Intermediate Similarity NPC106332
0.8 Intermediate Similarity NPC226863
0.8 Intermediate Similarity NPC472810
0.8 Intermediate Similarity NPC472809
0.7978 Intermediate Similarity NPC134072
0.7978 Intermediate Similarity NPC234993
0.7978 Intermediate Similarity NPC16967
0.7978 Intermediate Similarity NPC242848
0.7978 Intermediate Similarity NPC473153
0.7978 Intermediate Similarity NPC209297
0.7978 Intermediate Similarity NPC475380
0.7976 Intermediate Similarity NPC471219
0.7973 Intermediate Similarity NPC472266
0.7955 Intermediate Similarity NPC105490
0.7955 Intermediate Similarity NPC191521
0.7955 Intermediate Similarity NPC57117
0.7955 Intermediate Similarity NPC84893
0.7955 Intermediate Similarity NPC470255
0.7955 Intermediate Similarity NPC140277
0.7952 Intermediate Similarity NPC306951
0.7952 Intermediate Similarity NPC318515
0.7931 Intermediate Similarity NPC177037
0.7931 Intermediate Similarity NPC472814
0.7931 Intermediate Similarity NPC78594
0.7927 Intermediate Similarity NPC256112
0.7927 Intermediate Similarity NPC178676
0.7927 Intermediate Similarity NPC226988
0.7907 Intermediate Similarity NPC177141
0.7907 Intermediate Similarity NPC73995
0.7901 Intermediate Similarity NPC281880
0.7889 Intermediate Similarity NPC311241
0.7889 Intermediate Similarity NPC100912
0.7889 Intermediate Similarity NPC475446
0.7882 Intermediate Similarity NPC166857
0.7882 Intermediate Similarity NPC476600
0.7875 Intermediate Similarity NPC471220
0.7865 Intermediate Similarity NPC472441
0.7865 Intermediate Similarity NPC276110
0.7857 Intermediate Similarity NPC177932
0.7857 Intermediate Similarity NPC472442
0.7857 Intermediate Similarity NPC253604
0.7857 Intermediate Similarity NPC471795
0.7848 Intermediate Similarity NPC4509
0.7841 Intermediate Similarity NPC472640
0.7841 Intermediate Similarity NPC472641
0.7841 Intermediate Similarity NPC472303
0.7841 Intermediate Similarity NPC110022
0.7838 Intermediate Similarity NPC116013
0.7831 Intermediate Similarity NPC476927
0.7831 Intermediate Similarity NPC222358
0.7831 Intermediate Similarity NPC477124
0.7831 Intermediate Similarity NPC42476
0.7831 Intermediate Similarity NPC472440
0.7831 Intermediate Similarity NPC472377
0.7831 Intermediate Similarity NPC22611
0.7816 Intermediate Similarity NPC152467
0.7816 Intermediate Similarity NPC273199
0.7816 Intermediate Similarity NPC51486
0.7816 Intermediate Similarity NPC302280
0.7816 Intermediate Similarity NPC161638
0.7805 Intermediate Similarity NPC475665
0.7805 Intermediate Similarity NPC159148
0.7805 Intermediate Similarity NPC25554
0.7802 Intermediate Similarity NPC474440
0.7802 Intermediate Similarity NPC72647
0.7802 Intermediate Similarity NPC107806
0.7791 Intermediate Similarity NPC472302
0.7791 Intermediate Similarity NPC215831
0.7791 Intermediate Similarity NPC473879
0.7778 Intermediate Similarity NPC165632
0.7778 Intermediate Similarity NPC194132
0.7778 Intermediate Similarity NPC150646
0.7778 Intermediate Similarity NPC242767
0.7778 Intermediate Similarity NPC260796
0.7753 Intermediate Similarity NPC161998
0.7738 Intermediate Similarity NPC475100
0.7738 Intermediate Similarity NPC474693
0.7738 Intermediate Similarity NPC149869
0.7727 Intermediate Similarity NPC473944
0.7727 Intermediate Similarity NPC49420
0.7727 Intermediate Similarity NPC472953
0.7727 Intermediate Similarity NPC289479
0.7717 Intermediate Similarity NPC117685
0.7717 Intermediate Similarity NPC201406
0.7717 Intermediate Similarity NPC16601
0.7717 Intermediate Similarity NPC471413
0.7701 Intermediate Similarity NPC5509
0.7701 Intermediate Similarity NPC251528
0.7701 Intermediate Similarity NPC174342
0.7701 Intermediate Similarity NPC82876
0.7701 Intermediate Similarity NPC470734
0.7692 Intermediate Similarity NPC222244
0.7692 Intermediate Similarity NPC205143
0.7692 Intermediate Similarity NPC73911
0.7692 Intermediate Similarity NPC16349
0.7692 Intermediate Similarity NPC84335
0.7692 Intermediate Similarity NPC476768
0.7692 Intermediate Similarity NPC38530
0.7692 Intermediate Similarity NPC231751
0.7692 Intermediate Similarity NPC474343
0.7692 Intermediate Similarity NPC51499
0.7692 Intermediate Similarity NPC110937
0.7683 Intermediate Similarity NPC233332
0.7683 Intermediate Similarity NPC195424
0.7674 Intermediate Similarity NPC471796
0.7674 Intermediate Similarity NPC312561
0.7674 Intermediate Similarity NPC102640
0.7667 Intermediate Similarity NPC183012
0.7667 Intermediate Similarity NPC474909
0.7667 Intermediate Similarity NPC111273
0.7667 Intermediate Similarity NPC471915
0.7662 Intermediate Similarity NPC469660
0.7654 Intermediate Similarity NPC35574
0.7647 Intermediate Similarity NPC473659
0.7647 Intermediate Similarity NPC110405
0.7647 Intermediate Similarity NPC473251
0.7647 Intermediate Similarity NPC476678
0.7647 Intermediate Similarity NPC475860
0.7647 Intermediate Similarity NPC42586
0.7647 Intermediate Similarity NPC474694
0.764 Intermediate Similarity NPC475657
0.764 Intermediate Similarity NPC38232
0.764 Intermediate Similarity NPC115021
0.7634 Intermediate Similarity NPC303559
0.7634 Intermediate Similarity NPC471412
0.7632 Intermediate Similarity NPC276290
0.7625 Intermediate Similarity NPC92489
0.7619 Intermediate Similarity NPC79945
0.7614 Intermediate Similarity NPC220454
0.7614 Intermediate Similarity NPC212679
0.7614 Intermediate Similarity NPC477782
0.7614 Intermediate Similarity NPC469595
0.7609 Intermediate Similarity NPC159763
0.7609 Intermediate Similarity NPC124512
0.7609 Intermediate Similarity NPC275086
0.7609 Intermediate Similarity NPC278386
0.7609 Intermediate Similarity NPC473154
0.7609 Intermediate Similarity NPC325229
0.7609 Intermediate Similarity NPC278673
0.76 Intermediate Similarity NPC185587
0.759 Intermediate Similarity NPC229584
0.759 Intermediate Similarity NPC40228
0.759 Intermediate Similarity NPC14203
0.7586 Intermediate Similarity NPC242448
0.7586 Intermediate Similarity NPC69713
0.7586 Intermediate Similarity NPC277771
0.7586 Intermediate Similarity NPC477128
0.7582 Intermediate Similarity NPC154526
0.7582 Intermediate Similarity NPC472362
0.7582 Intermediate Similarity NPC472363
0.7582 Intermediate Similarity NPC29952
0.7564 Intermediate Similarity NPC257618

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC189206 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
0.8375 Intermediate Similarity NPD4752 Clinical (unspecified phase)
0.7857 Intermediate Similarity NPD1694 Approved
0.7609 Intermediate Similarity NPD7638 Approved
0.7609 Intermediate Similarity NPD4225 Approved
0.7527 Intermediate Similarity NPD7640 Approved
0.7527 Intermediate Similarity NPD7639 Approved
0.7356 Intermediate Similarity NPD6684 Approved
0.7356 Intermediate Similarity NPD6409 Approved
0.7356 Intermediate Similarity NPD7146 Approved
0.7356 Intermediate Similarity NPD5330 Approved
0.7356 Intermediate Similarity NPD7334 Approved
0.7356 Intermediate Similarity NPD7521 Approved
0.7303 Intermediate Similarity NPD6051 Approved
0.7237 Intermediate Similarity NPD2685 Clinical (unspecified phase)
0.7191 Intermediate Similarity NPD6903 Approved
0.7191 Intermediate Similarity NPD7513 Clinical (unspecified phase)
0.701 Intermediate Similarity NPD7632 Discontinued
0.7 Intermediate Similarity NPD5737 Approved
0.7 Intermediate Similarity NPD6672 Approved
0.6989 Remote Similarity NPD7748 Approved
0.6989 Remote Similarity NPD7900 Approved
0.6989 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6957 Remote Similarity NPD5693 Phase 1
0.6932 Remote Similarity NPD6400 Clinical (unspecified phase)
0.69 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6897 Remote Similarity NPD5209 Approved
0.6889 Remote Similarity NPD3573 Approved
0.6867 Remote Similarity NPD8039 Approved
0.6832 Remote Similarity NPD6686 Approved
0.6778 Remote Similarity NPD3618 Phase 1
0.6774 Remote Similarity NPD7515 Phase 2
0.6771 Remote Similarity NPD7902 Approved
0.6765 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6702 Remote Similarity NPD6399 Phase 3
0.6699 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6667 Remote Similarity NPD5325 Clinical (unspecified phase)
0.663 Remote Similarity NPD5208 Approved
0.6596 Remote Similarity NPD7637 Suspended
0.6562 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6559 Remote Similarity NPD5328 Approved
0.6559 Remote Similarity NPD6904 Approved
0.6559 Remote Similarity NPD6673 Approved
0.6559 Remote Similarity NPD6080 Approved
0.6556 Remote Similarity NPD3666 Approved
0.6556 Remote Similarity NPD3133 Approved
0.6556 Remote Similarity NPD3665 Phase 1
0.6517 Remote Similarity NPD3667 Approved
0.6484 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6481 Remote Similarity NPD7115 Discovery
0.6471 Remote Similarity NPD5739 Approved
0.6471 Remote Similarity NPD7128 Approved
0.6471 Remote Similarity NPD6675 Approved
0.6471 Remote Similarity NPD6008 Approved
0.6471 Remote Similarity NPD6402 Approved
0.6465 Remote Similarity NPD6648 Approved
0.6458 Remote Similarity NPD6001 Approved
0.6429 Remote Similarity NPD6083 Phase 2
0.6429 Remote Similarity NPD6084 Phase 2
0.6422 Remote Similarity NPD7327 Approved
0.6422 Remote Similarity NPD7328 Approved
0.6421 Remote Similarity NPD8035 Phase 2
0.6421 Remote Similarity NPD6079 Approved
0.6421 Remote Similarity NPD8034 Phase 2
0.6413 Remote Similarity NPD6098 Approved
0.6408 Remote Similarity NPD5701 Approved
0.6408 Remote Similarity NPD5697 Approved
0.64 Remote Similarity NPD5344 Discontinued
0.6395 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6392 Remote Similarity NPD5695 Phase 3
0.6392 Remote Similarity NPD1698 Clinical (unspecified phase)
0.6374 Remote Similarity NPD3668 Phase 3
0.6374 Remote Similarity NPD4786 Approved
0.6364 Remote Similarity NPD7516 Approved
0.6364 Remote Similarity NPD7645 Phase 2
0.6364 Remote Similarity NPD5696 Approved
0.6354 Remote Similarity NPD4202 Approved
0.6353 Remote Similarity NPD6926 Approved
0.6353 Remote Similarity NPD6924 Approved
0.6346 Remote Similarity NPD6011 Approved
0.6346 Remote Similarity NPD6881 Approved
0.6346 Remote Similarity NPD6899 Approved
0.6346 Remote Similarity NPD7320 Approved
0.6316 Remote Similarity NPD5785 Approved
0.6316 Remote Similarity NPD5207 Approved
0.6316 Remote Similarity NPD5692 Phase 3
0.6306 Remote Similarity NPD8294 Approved
0.6306 Remote Similarity NPD8377 Approved
0.6304 Remote Similarity NPD6082 Clinical (unspecified phase)
0.6292 Remote Similarity NPD7525 Registered
0.6286 Remote Similarity NPD6014 Approved
0.6286 Remote Similarity NPD6372 Approved
0.6286 Remote Similarity NPD6013 Approved
0.6286 Remote Similarity NPD6373 Approved
0.6286 Remote Similarity NPD6012 Approved
0.6279 Remote Similarity NPD6942 Approved
0.6279 Remote Similarity NPD7339 Approved
0.6264 Remote Similarity NPD6695 Phase 3
0.625 Remote Similarity NPD8033 Approved
0.625 Remote Similarity NPD8335 Approved
0.625 Remote Similarity NPD8296 Approved
0.625 Remote Similarity NPD8380 Approved
0.625 Remote Similarity NPD6411 Approved
0.625 Remote Similarity NPD8378 Approved
0.625 Remote Similarity NPD5694 Approved
0.625 Remote Similarity NPD8379 Approved
0.625 Remote Similarity NPD6050 Approved
0.6237 Remote Similarity NPD4623 Approved
0.6237 Remote Similarity NPD4519 Discontinued
0.6237 Remote Similarity NPD5279 Phase 3
0.6226 Remote Similarity NPD7290 Approved
0.6226 Remote Similarity NPD6883 Approved
0.6226 Remote Similarity NPD7102 Approved
0.6211 Remote Similarity NPD1695 Approved
0.6207 Remote Similarity NPD6933 Approved
0.6196 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6186 Remote Similarity NPD5779 Approved
0.6186 Remote Similarity NPD5778 Approved
0.618 Remote Similarity NPD6929 Approved
0.618 Remote Similarity NPD4195 Approved
0.6174 Remote Similarity NPD7507 Approved
0.6168 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6168 Remote Similarity NPD6617 Approved
0.6168 Remote Similarity NPD6649 Approved
0.6168 Remote Similarity NPD6869 Approved
0.6168 Remote Similarity NPD6847 Approved
0.6168 Remote Similarity NPD6650 Approved
0.6168 Remote Similarity NPD8130 Phase 1
0.6162 Remote Similarity NPD5221 Approved
0.6162 Remote Similarity NPD4697 Phase 3
0.6162 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6162 Remote Similarity NPD5222 Approved
0.6154 Remote Similarity NPD4223 Phase 3
0.6154 Remote Similarity NPD4221 Approved
0.6146 Remote Similarity NPD7838 Discovery
0.6146 Remote Similarity NPD6698 Approved
0.6146 Remote Similarity NPD46 Approved
0.6129 Remote Similarity NPD1733 Clinical (unspecified phase)
0.6118 Remote Similarity NPD7151 Approved
0.6118 Remote Similarity NPD7152 Approved
0.6118 Remote Similarity NPD7150 Approved
0.6111 Remote Similarity NPD6931 Approved
0.6111 Remote Similarity NPD8297 Approved
0.6111 Remote Similarity NPD6930 Phase 2
0.6111 Remote Similarity NPD7509 Discontinued
0.6111 Remote Similarity NPD6882 Approved
0.6111 Remote Similarity NPD4695 Discontinued
0.61 Remote Similarity NPD4755 Approved
0.61 Remote Similarity NPD5173 Approved
0.6092 Remote Similarity NPD8264 Approved
0.6076 Remote Similarity NPD1145 Discontinued
0.6071 Remote Similarity NPD4137 Phase 3
0.6071 Remote Similarity NPD6923 Approved
0.6071 Remote Similarity NPD6922 Approved
0.6067 Remote Similarity NPD5784 Clinical (unspecified phase)
0.6067 Remote Similarity NPD3617 Approved
0.6067 Remote Similarity NPD7322 Clinical (unspecified phase)
0.6042 Remote Similarity NPD5764 Clinical (unspecified phase)
0.6042 Remote Similarity NPD4753 Phase 2
0.6042 Remote Similarity NPD6101 Approved
0.6022 Remote Similarity NPD4197 Approved
0.6019 Remote Similarity NPD5211 Phase 2
0.6017 Remote Similarity NPD7319 Approved
0.6 Remote Similarity NPD4192 Approved
0.6 Remote Similarity NPD4751 Clinical (unspecified phase)
0.6 Remote Similarity NPD7750 Discontinued
0.6 Remote Similarity NPD4691 Approved
0.6 Remote Similarity NPD4194 Approved
0.6 Remote Similarity NPD4193 Approved
0.6 Remote Similarity NPD7524 Approved
0.6 Remote Similarity NPD7143 Approved
0.6 Remote Similarity NPD4747 Approved
0.6 Remote Similarity NPD4191 Approved
0.6 Remote Similarity NPD7144 Approved
0.598 Remote Similarity NPD4700 Approved
0.598 Remote Similarity NPD5286 Approved
0.598 Remote Similarity NPD5285 Approved
0.598 Remote Similarity NPD4696 Approved
0.5965 Remote Similarity NPD7503 Approved
0.5957 Remote Similarity NPD1696 Phase 3
0.5957 Remote Similarity NPD5329 Approved
0.5955 Remote Similarity NPD6925 Approved
0.5955 Remote Similarity NPD5776 Phase 2
0.5946 Remote Similarity NPD6274 Approved
0.5946 Remote Similarity NPD6868 Approved
0.5934 Remote Similarity NPD5790 Clinical (unspecified phase)
0.5934 Remote Similarity NPD7514 Phase 3
0.5934 Remote Similarity NPD7332 Phase 2
0.593 Remote Similarity NPD5777 Approved
0.5922 Remote Similarity NPD5223 Approved
0.5918 Remote Similarity NPD5284 Approved
0.5918 Remote Similarity NPD5281 Approved
0.5914 Remote Similarity NPD5362 Discontinued
0.5914 Remote Similarity NPD7154 Phase 3
0.5909 Remote Similarity NPD4632 Approved
0.5905 Remote Similarity NPD5141 Approved
0.59 Remote Similarity NPD5654 Approved
0.5895 Remote Similarity NPD3574 Clinical (unspecified phase)
0.5895 Remote Similarity NPD4689 Approved
0.5895 Remote Similarity NPD5205 Approved
0.5895 Remote Similarity NPD4138 Approved

Structure

External Identifiers

PubChem CID   14448070
ChEMBL   CHEMBL485805
ZINC  

Physicochemical Properties

Molecular Weight:  232.15
ALogP:  1.4507
MLogP:  2.89
XLogP:  3.355
# Rotatable Bonds:  2
Polar Surface Area:  26.3
# H-Bond Aceptor:  2
# H-Bond Donor:  0
# Rings:  3
# Heavy Atoms:  17

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
Similar NPs/Drugs