Natural Product: NPC29531

Natural Product ID:  NPC29531
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C41H50N6O10
Standard InCHIKey:  JEBXCSWDHPJRMW-LZQLRFBTSA-N
Standard InCHI:  InChI=1S/C41H50N6O10/c1-22-36(49)43-23(2)39(52)45(4)30(17-25-9-13-28(55-7)14-10-25)38(51)44-24(3)40(53)47(6)32-18-26-11-15-29(16-12-26)57-34-21-27(20-33(48)35(34)56-8)19-31(37(50)42-22)46(5)41(32)54/h9-16,20-24,30-32,48H,17-19H2,1-8H3,(H,42,50)(H,43,49)(H,44,51)/t22-,23+,24+,30+,31+,32+/m1/s1
Canonical SMILES:  COc1ccc(cc1)C[C@H]1C(=N[C@@H](C)C(=O)N(C)[C@H]2Cc3ccc(cc3)Oc3cc(C[C@H](N(C2=O)C)C(=N[C@@H](C(=N[C@H](C(=O)N1C)C)O)C)O)cc(c3OC)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
NPO26542 Rubia cordifolia Species Rubiaceae Eukaryota PMID[18078747]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT168 Cell Line P388 Mus musculus IC50 = 0.012 ug/ml 19105653

  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 NPC29531 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
0.954 High Similarity NPC471563
0.9524 High Similarity NPC32064
0.9302 High Similarity NPC138083
0.9286 High Similarity NPC164608
0.9249 High Similarity NPC276120
0.9091 High Similarity NPC174122
0.9091 High Similarity NPC64140
0.9056 High Similarity NPC50548
0.9034 High Similarity NPC234069
0.9 High Similarity NPC144314
0.8944 High Similarity NPC149962
0.8798 High Similarity NPC123859
0.875 High Similarity NPC242728
0.8125 Intermediate Similarity NPC473460
0.8083 Intermediate Similarity NPC473422
0.804 Intermediate Similarity NPC471531
0.8023 Intermediate Similarity NPC127402
0.8 Intermediate Similarity NPC281629
0.7926 Intermediate Similarity NPC473407
0.7926 Intermediate Similarity NPC473378
0.7919 Intermediate Similarity NPC471561
0.7886 Intermediate Similarity NPC107602
0.7884 Intermediate Similarity NPC41122
0.7884 Intermediate Similarity NPC318805
0.7876 Intermediate Similarity NPC469689
0.7876 Intermediate Similarity NPC471031
0.7865 Intermediate Similarity NPC50380
0.7865 Intermediate Similarity NPC179250
0.7849 Intermediate Similarity NPC315542
0.7839 Intermediate Similarity NPC471532
0.7829 Intermediate Similarity NPC56635
0.7784 Intermediate Similarity NPC287757
0.7784 Intermediate Similarity NPC319320
0.7765 Intermediate Similarity NPC254700
0.7754 Intermediate Similarity NPC30779
0.7746 Intermediate Similarity NPC233702
0.772 Intermediate Similarity NPC234318
0.7708 Intermediate Similarity NPC85381
0.7705 Intermediate Similarity NPC155506
0.7705 Intermediate Similarity NPC159767
0.7701 Intermediate Similarity NPC286119
0.7692 Intermediate Similarity NPC475654
0.7674 Intermediate Similarity NPC5462
0.766 Intermediate Similarity NPC49075
0.766 Intermediate Similarity NPC222661
0.766 Intermediate Similarity NPC258657
0.766 Intermediate Similarity NPC271013
0.766 Intermediate Similarity NPC182052
0.766 Intermediate Similarity NPC279228
0.766 Intermediate Similarity NPC328155
0.766 Intermediate Similarity NPC104196
0.766 Intermediate Similarity NPC15414
0.766 Intermediate Similarity NPC54654
0.766 Intermediate Similarity NPC251735
0.766 Intermediate Similarity NPC90998
0.766 Intermediate Similarity NPC290005
0.766 Intermediate Similarity NPC42663
0.766 Intermediate Similarity NPC7715
0.766 Intermediate Similarity NPC285931
0.766 Intermediate Similarity NPC229373
0.766 Intermediate Similarity NPC290582
0.766 Intermediate Similarity NPC239824
0.766 Intermediate Similarity NPC223690
0.766 Intermediate Similarity NPC217748
0.766 Intermediate Similarity NPC311973
0.766 Intermediate Similarity NPC185639
0.766 Intermediate Similarity NPC181796
0.766 Intermediate Similarity NPC8836
0.7637 Intermediate Similarity NPC196091
0.7633 Intermediate Similarity NPC296898
0.7626 Intermediate Similarity NPC477666
0.7619 Intermediate Similarity NPC254441
0.7619 Intermediate Similarity NPC274716
0.7619 Intermediate Similarity NPC167116
0.7616 Intermediate Similarity NPC16188
0.761 Intermediate Similarity NPC82056
0.7609 Intermediate Similarity NPC476227
0.7609 Intermediate Similarity NPC26108
0.7609 Intermediate Similarity NPC473402
0.7609 Intermediate Similarity NPC473354
0.7606 Intermediate Similarity NPC294951
0.7596 Intermediate Similarity NPC230611
0.7594 Intermediate Similarity NPC329816
0.7586 Intermediate Similarity NPC277857
0.7586 Intermediate Similarity NPC115144
0.7581 Intermediate Similarity NPC45037
0.7554 Intermediate Similarity NPC204908
0.7554 Intermediate Similarity NPC83198
0.7554 Intermediate Similarity NPC306804
0.7554 Intermediate Similarity NPC273755
0.7553 Intermediate Similarity NPC471526
0.7543 Intermediate Similarity NPC470935
0.7543 Intermediate Similarity NPC471032
0.7539 Intermediate Similarity NPC124626
0.7539 Intermediate Similarity NPC212237
0.7539 Intermediate Similarity NPC116465
0.7528 Intermediate Similarity NPC475557
0.7527 Intermediate Similarity NPC107938
0.7527 Intermediate Similarity NPC294516
0.7525 Intermediate Similarity NPC311357
0.7513 Intermediate Similarity NPC195538
0.75 Intermediate Similarity NPC202198
0.75 Intermediate Similarity NPC22115
0.75 Intermediate Similarity NPC275680
0.75 Intermediate Similarity NPC89831
0.7486 Intermediate Similarity NPC186617
0.7486 Intermediate Similarity NPC324081
0.7474 Intermediate Similarity NPC476202
0.7471 Intermediate Similarity NPC9373
0.7461 Intermediate Similarity NPC175890
0.7461 Intermediate Similarity NPC82457
0.7461 Intermediate Similarity NPC274661
0.7461 Intermediate Similarity NPC206900
0.7461 Intermediate Similarity NPC11296
0.7461 Intermediate Similarity NPC48490
0.7459 Intermediate Similarity NPC137627
0.7459 Intermediate Similarity NPC473748
0.7446 Intermediate Similarity NPC473693
0.7446 Intermediate Similarity NPC90984
0.7446 Intermediate Similarity NPC471568
0.7436 Intermediate Similarity NPC478092
0.7436 Intermediate Similarity NPC30182
0.7436 Intermediate Similarity NPC473589
0.7436 Intermediate Similarity NPC478091
0.7433 Intermediate Similarity NPC232386
0.7433 Intermediate Similarity NPC152680
0.7433 Intermediate Similarity NPC190783
0.7432 Intermediate Similarity NPC141957
0.7432 Intermediate Similarity NPC328649
0.7427 Intermediate Similarity NPC38964
0.7423 Intermediate Similarity NPC60295
0.7423 Intermediate Similarity NPC191132
0.7419 Intermediate Similarity NPC279871
0.7419 Intermediate Similarity NPC471165
0.7418 Intermediate Similarity NPC472923
0.7409 Intermediate Similarity NPC163961
0.7409 Intermediate Similarity NPC473305
0.7407 Intermediate Similarity NPC476321
0.7399 Intermediate Similarity NPC222039
0.7399 Intermediate Similarity NPC100478
0.7396 Intermediate Similarity NPC249996
0.7396 Intermediate Similarity NPC16357
0.7396 Intermediate Similarity NPC302245
0.7396 Intermediate Similarity NPC95426
0.7394 Intermediate Similarity NPC194671
0.7394 Intermediate Similarity NPC269750
0.7385 Intermediate Similarity NPC478093
0.7385 Intermediate Similarity NPC24260
0.738 Intermediate Similarity NPC50016
0.7377 Intermediate Similarity NPC304074
0.7377 Intermediate Similarity NPC471771
0.7377 Intermediate Similarity NPC290755
0.7366 Intermediate Similarity NPC477665
0.7363 Intermediate Similarity NPC329837
0.7358 Intermediate Similarity NPC65312
0.7358 Intermediate Similarity NPC139783
0.7351 Intermediate Similarity NPC42549
0.7351 Intermediate Similarity NPC268503
0.7351 Intermediate Similarity NPC264850
0.7351 Intermediate Similarity NPC329717
0.7351 Intermediate Similarity NPC317272
0.7351 Intermediate Similarity NPC474858
0.7351 Intermediate Similarity NPC40234
0.7351 Intermediate Similarity NPC13916
0.7351 Intermediate Similarity NPC256012
0.7351 Intermediate Similarity NPC240841
0.7351 Intermediate Similarity NPC250846
0.7346 Intermediate Similarity NPC475349
0.7346 Intermediate Similarity NPC475565
0.7346 Intermediate Similarity NPC475292
0.7333 Intermediate Similarity NPC475597
0.7333 Intermediate Similarity NPC473716
0.733 Intermediate Similarity NPC473562
0.733 Intermediate Similarity NPC245974
0.733 Intermediate Similarity NPC471048
0.733 Intermediate Similarity NPC471050
0.733 Intermediate Similarity NPC471049
0.7326 Intermediate Similarity NPC476989
0.7326 Intermediate Similarity NPC299583
0.7322 Intermediate Similarity NPC223207
0.7321 Intermediate Similarity NPC114102
0.7314 Intermediate Similarity NPC247298
0.7311 Intermediate Similarity NPC475624
0.7304 Intermediate Similarity NPC293347
0.7303 Intermediate Similarity NPC262166
0.7302 Intermediate Similarity NPC475421
0.7299 Intermediate Similarity NPC470846
0.7297 Intermediate Similarity NPC24465
0.7291 Intermediate Similarity NPC79130
0.7288 Intermediate Similarity NPC473491
0.7287 Intermediate Similarity NPC198498
0.7287 Intermediate Similarity NPC276890
0.7287 Intermediate Similarity NPC196243
0.7287 Intermediate Similarity NPC115284
0.7287 Intermediate Similarity NPC317439
0.7287 Intermediate Similarity NPC76682
0.7287 Intermediate Similarity NPC317145
0.7287 Intermediate Similarity NPC227060
0.7287 Intermediate Similarity NPC63646
0.7287 Intermediate Similarity NPC10908

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC29531 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
0.7935 Intermediate Similarity NPD7132 Clinical (unspecified phase)
0.7907 Intermediate Similarity NPD7131 Phase 3
0.774 Intermediate Similarity NPD5773 Approved
0.774 Intermediate Similarity NPD5772 Approved
0.7719 Intermediate Similarity NPD2219 Phase 1
0.767 Intermediate Similarity NPD4678 Approved
0.767 Intermediate Similarity NPD4675 Approved
0.7668 Intermediate Similarity NPD7667 Clinical (unspecified phase)
0.766 Intermediate Similarity NPD8054 Approved
0.766 Intermediate Similarity NPD6851 Approved
0.766 Intermediate Similarity NPD8053 Approved
0.766 Intermediate Similarity NPD6853 Approved
0.766 Intermediate Similarity NPD7090 Clinical (unspecified phase)
0.7634 Intermediate Similarity NPD6297 Approved
0.7602 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7592 Intermediate Similarity NPD6377 Clinical (unspecified phase)
0.7541 Intermediate Similarity NPD7608 Discontinued
0.7537 Intermediate Similarity NPD7827 Phase 1
0.7514 Intermediate Similarity NPD7975 Clinical (unspecified phase)
0.7444 Intermediate Similarity NPD6818 Clinical (unspecified phase)
0.7432 Intermediate Similarity NPD5677 Discontinued
0.7391 Intermediate Similarity NPD7484 Phase 3
0.7391 Intermediate Similarity NPD7485 Phase 3
0.7386 Intermediate Similarity NPD4123 Phase 3
0.7348 Intermediate Similarity NPD7046 Clinical (unspecified phase)
0.733 Intermediate Similarity NPD7281 Phase 3
0.733 Intermediate Similarity NPD7280 Phase 3
0.7318 Intermediate Similarity NPD4005 Discontinued
0.7316 Intermediate Similarity NPD7038 Approved
0.7316 Intermediate Similarity NPD7039 Approved
0.7312 Intermediate Similarity NPD5137 Approved
0.7303 Intermediate Similarity NPD6662 Clinical (unspecified phase)
0.7291 Intermediate Similarity NPD7263 Phase 2
0.7287 Intermediate Similarity NPD8099 Discontinued
0.7287 Intermediate Similarity NPD8251 Approved
0.7287 Intermediate Similarity NPD8252 Approved
0.7286 Intermediate Similarity NPD7811 Phase 3
0.7286 Intermediate Similarity NPD7810 Phase 3
0.7282 Intermediate Similarity NPD5525 Clinical (unspecified phase)
0.7268 Intermediate Similarity NPD7906 Approved
0.7249 Intermediate Similarity NPD8156 Discontinued
0.7243 Intermediate Similarity NPD6746 Phase 2
0.7238 Intermediate Similarity NPD7110 Phase 1
0.7238 Intermediate Similarity NPD7109 Clinical (unspecified phase)
0.7232 Intermediate Similarity NPD5297 Approved
0.7222 Intermediate Similarity NPD7261 Clinical (unspecified phase)
0.7216 Intermediate Similarity NPD5241 Discontinued
0.7214 Intermediate Similarity NPD2493 Approved
0.7214 Intermediate Similarity NPD2494 Approved
0.7207 Intermediate Similarity NPD2122 Discontinued
0.7198 Intermediate Similarity NPD7945 Clinical (unspecified phase)
0.7191 Intermediate Similarity NPD7447 Phase 1
0.7179 Intermediate Similarity NPD7291 Discontinued
0.7175 Intermediate Similarity NPD7124 Phase 2
0.7174 Intermediate Similarity NPD6788 Approved
0.7158 Intermediate Similarity NPD6668 Clinical (unspecified phase)
0.7151 Intermediate Similarity NPD7201 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7118 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD6072 Discontinued
0.7143 Intermediate Similarity NPD7596 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD4357 Discontinued
0.7129 Intermediate Similarity NPD3450 Approved
0.7129 Intermediate Similarity NPD3452 Approved
0.7118 Intermediate Similarity NPD5718 Phase 2
0.7108 Intermediate Similarity NPD4582 Approved
0.7108 Intermediate Similarity NPD4583 Approved
0.7102 Intermediate Similarity NPD3060 Approved
0.7101 Intermediate Similarity NPD5752 Clinical (unspecified phase)
0.7098 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD3146 Approved
0.7095 Intermediate Similarity NPD1754 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD3688 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD7047 Phase 3
0.7088 Intermediate Similarity NPD6875 Approved
0.7088 Intermediate Similarity NPD6876 Approved
0.7085 Intermediate Similarity NPD4413 Clinical (unspecified phase)
0.7068 Intermediate Similarity NPD42 Phase 2
0.7068 Intermediate Similarity NPD6042 Phase 2
0.7065 Intermediate Similarity NPD2977 Approved
0.7065 Intermediate Similarity NPD2978 Approved
0.7059 Intermediate Similarity NPD4004 Approved
0.7059 Intermediate Similarity NPD4002 Approved
0.7056 Intermediate Similarity NPD7861 Discontinued
0.7049 Intermediate Similarity NPD6386 Approved
0.7049 Intermediate Similarity NPD6385 Approved
0.7039 Intermediate Similarity NPD7213 Phase 3
0.7039 Intermediate Similarity NPD7212 Phase 2
0.7033 Intermediate Similarity NPD824 Approved
0.7029 Intermediate Similarity NPD7450 Phase 2
0.7027 Intermediate Similarity NPD5967 Approved
0.7022 Intermediate Similarity NPD5307 Clinical (unspecified phase)
0.702 Intermediate Similarity NPD2488 Approved
0.702 Intermediate Similarity NPD2490 Approved
0.7015 Intermediate Similarity NPD2975 Approved
0.7015 Intermediate Similarity NPD2974 Approved
0.7015 Intermediate Similarity NPD2973 Approved
0.7006 Intermediate Similarity NPD4237 Approved
0.7006 Intermediate Similarity NPD4162 Approved
0.7006 Intermediate Similarity NPD4236 Phase 3
0.7005 Intermediate Similarity NPD4157 Discontinued
0.7 Intermediate Similarity NPD6312 Discontinued
0.699 Remote Similarity NPD7607 Clinical (unspecified phase)
0.6978 Remote Similarity NPD3686 Approved
0.6978 Remote Similarity NPD3687 Approved
0.6977 Remote Similarity NPD5745 Approved
0.6977 Remote Similarity NPD6997 Phase 2
0.6977 Remote Similarity NPD2674 Phase 3
0.6974 Remote Similarity NPD4577 Approved
0.6974 Remote Similarity NPD4578 Approved
0.6961 Remote Similarity NPD7526 Approved
0.6961 Remote Similarity NPD7527 Clinical (unspecified phase)
0.6961 Remote Similarity NPD52 Approved
0.6954 Remote Similarity NPD4663 Approved
0.6952 Remote Similarity NPD6971 Discontinued
0.6952 Remote Similarity NPD4055 Discovery
0.6952 Remote Similarity NPD8031 Discontinued
0.6947 Remote Similarity NPD5242 Approved
0.6934 Remote Similarity NPD8149 Discontinued
0.6923 Remote Similarity NPD7585 Approved
0.6919 Remote Similarity NPD7243 Clinical (unspecified phase)
0.6919 Remote Similarity NPD8019 Approved
0.6916 Remote Similarity NPD8318 Clinical (unspecified phase)
0.6915 Remote Similarity NPD3473 Clinical (unspecified phase)
0.6912 Remote Similarity NPD4580 Approved
0.6885 Remote Similarity NPD4210 Discontinued
0.6882 Remote Similarity NPD7972 Discontinued
0.6882 Remote Similarity NPD2801 Approved
0.6875 Remote Similarity NPD7583 Approved
0.6872 Remote Similarity NPD6331 Phase 2
0.6872 Remote Similarity NPD6658 Clinical (unspecified phase)
0.6868 Remote Similarity NPD5261 Clinical (unspecified phase)
0.6863 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6862 Remote Similarity NPD8070 Approved
0.686 Remote Similarity NPD5746 Approved
0.6859 Remote Similarity NPD8051 Clinical (unspecified phase)
0.6854 Remote Similarity NPD3655 Clinical (unspecified phase)
0.6854 Remote Similarity NPD7153 Discontinued
0.685 Remote Similarity NPD6504 Approved
0.685 Remote Similarity NPD6505 Approved
0.6848 Remote Similarity NPD8158 Clinical (unspecified phase)
0.6848 Remote Similarity NPD3455 Phase 2
0.6837 Remote Similarity NPD7549 Discontinued
0.6837 Remote Similarity NPD3936 Clinical (unspecified phase)
0.6834 Remote Similarity NPD4435 Approved
0.6833 Remote Similarity NPD3692 Discontinued
0.6828 Remote Similarity NPD1934 Approved
0.6826 Remote Similarity NPD8153 Approved
0.6826 Remote Similarity NPD8152 Approved
0.6823 Remote Similarity NPD6168 Clinical (unspecified phase)
0.6823 Remote Similarity NPD6166 Phase 2
0.6823 Remote Similarity NPD6167 Clinical (unspecified phase)
0.6823 Remote Similarity NPD2489 Approved
0.6823 Remote Similarity NPD27 Approved
0.6821 Remote Similarity NPD3145 Approved
0.6821 Remote Similarity NPD3144 Approved
0.6821 Remote Similarity NPD6996 Clinical (unspecified phase)
0.6816 Remote Similarity NPD6860 Clinical (unspecified phase)
0.6813 Remote Similarity NPD3157 Approved
0.6813 Remote Similarity NPD3158 Phase 1
0.6813 Remote Similarity NPD3536 Discontinued
0.6811 Remote Similarity NPD6502 Phase 2
0.6809 Remote Similarity NPD5019 Clinical (unspecified phase)
0.6809 Remote Similarity NPD4868 Clinical (unspecified phase)
0.6806 Remote Similarity NPD3051 Approved
0.6806 Remote Similarity NPD2517 Approved
0.6806 Remote Similarity NPD7315 Approved
0.6804 Remote Similarity NPD5313 Approved
0.6804 Remote Similarity NPD5312 Approved
0.6802 Remote Similarity NPD7311 Approved
0.6802 Remote Similarity NPD7312 Approved
0.6802 Remote Similarity NPD7310 Approved
0.6802 Remote Similarity NPD3534 Clinical (unspecified phase)
0.6802 Remote Similarity NPD7313 Approved
0.6796 Remote Similarity NPD6666 Approved
0.6796 Remote Similarity NPD6667 Approved
0.6794 Remote Similarity NPD7584 Approved
0.6786 Remote Similarity NPD5192 Clinical (unspecified phase)
0.6784 Remote Similarity NPD6584 Phase 3
0.6784 Remote Similarity NPD4434 Approved
0.6782 Remote Similarity NPD2245 Discovery
0.6779 Remote Similarity NPD4040 Phase 1
0.6776 Remote Similarity NPD1975 Clinical (unspecified phase)
0.6774 Remote Similarity NPD5089 Approved
0.6774 Remote Similarity NPD7615 Clinical (unspecified phase)
0.6774 Remote Similarity NPD5090 Approved
0.6772 Remote Similarity NPD7831 Phase 2
0.6772 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6772 Remote Similarity NPD7833 Phase 2
0.6771 Remote Similarity NPD2970 Approved
0.6771 Remote Similarity NPD2969 Approved
0.6769 Remote Similarity NPD5485 Approved
0.6769 Remote Similarity NPD5484 Approved
0.6768 Remote Similarity NPD7309 Approved
0.6763 Remote Similarity NPD3027 Phase 3
0.676 Remote Similarity NPD4664 Clinical (unspecified phase)
0.6757 Remote Similarity NPD6523 Clinical (unspecified phase)
0.6755 Remote Similarity NPD5353 Approved
0.6754 Remote Similarity NPD2516 Approved
0.6753 Remote Similarity NPD7177 Discontinued
0.6753 Remote Similarity NPD5940 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   25033039
ChEMBL   CHEMBL404614
ZINC  

Physicochemical Properties

Molecular Weight:  786.36
ALogP:  -3.1618
MLogP:  4.21
XLogP:  3.025
# Rotatable Bonds:  16
Polar Surface Area:  206.62
# H-Bond Aceptor:  12
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  57

Download Data

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