Natural Product: NPC939

Natural Product ID:  NPC939
Common Name:   Bitalin A
IUPAC Name:   1-[(2S)-2-(3-hydroxyprop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]ethanone
Synonyms:  
Molecular Formula:   C13H14O3
Standard InCHIKey:  JRWKMIYLVXKKAN-ZDUSSCGKSA-N
Standard InCHI:  InChI=1S/C13H14O3/c1-8(7-14)13-6-11-5-10(9(2)15)3-4-12(11)16-13/h3-5,13-14H,1,6-7H2,2H3/t13-/m0/s1
Canonical SMILES:  OCC(=C)[C@@H]1Cc2c(O1)ccc(c2)C(=O)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
NPO32653 helichrysum italicum ssp. microphyllum Species Asteraceae Eukaryota PMID[17315926]
NPO25148 Helichrysum italicum Species Asteraceae Eukaryota PMID[11678669]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT454 Organism Tenebrio molitor Tenebrio molitor Activity = 8.6 day PubChem BioAssay data set
NPT32 Organism Mus musculus Mus musculus Activity = 50 % 25682561
NPT454 Organism Tenebrio molitor Tenebrio molitor Activity = 75 % 20439614

  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 NPC939 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
0.9508 High Similarity NPC141252
0.9508 High Similarity NPC11799
0.9355 High Similarity NPC470858
0.9213 High Similarity NPC66246
0.9213 High Similarity NPC170546
0.9141 High Similarity NPC183348
0.9141 High Similarity NPC282230
0.907 High Similarity NPC15083
0.907 High Similarity NPC470976
0.907 High Similarity NPC196979
0.907 High Similarity NPC470977
0.903 High Similarity NPC37206
0.903 High Similarity NPC137009
0.9 High Similarity NPC470859
0.8759 High Similarity NPC171870
0.8731 High Similarity NPC163029
0.8722 High Similarity NPC247743
0.8702 High Similarity NPC109778
0.8692 High Similarity NPC50583
0.864 High Similarity NPC473767
0.8636 High Similarity NPC279596
0.8603 High Similarity NPC62735
0.8592 High Similarity NPC88886
0.8592 High Similarity NPC104172
0.8582 High Similarity NPC66991
0.8582 High Similarity NPC14875
0.8571 High Similarity NPC470857
0.8571 High Similarity NPC297788
0.8561 High Similarity NPC245395
0.8551 High Similarity NPC184053
0.855 High Similarity NPC2401
0.8538 High Similarity NPC237868
0.8521 High Similarity NPC168085
0.8519 High Similarity NPC164136
0.8516 High Similarity NPC69403
0.8516 High Similarity NPC291189
0.8511 High Similarity NPC286038
0.8485 Intermediate Similarity NPC473019
0.8478 Intermediate Similarity NPC139554
0.8472 Intermediate Similarity NPC474772
0.8472 Intermediate Similarity NPC474744
0.8472 Intermediate Similarity NPC472423
0.8462 Intermediate Similarity NPC317492
0.8462 Intermediate Similarity NPC39929
0.8462 Intermediate Similarity NPC296030
0.8456 Intermediate Similarity NPC84699
0.8456 Intermediate Similarity NPC60667
0.8456 Intermediate Similarity NPC151113
0.8451 Intermediate Similarity NPC202494
0.8443 Intermediate Similarity NPC23332
0.844 Intermediate Similarity NPC124780
0.844 Intermediate Similarity NPC87486
0.8429 Intermediate Similarity NPC162476
0.8429 Intermediate Similarity NPC130206
0.8421 Intermediate Similarity NPC327457
0.8421 Intermediate Similarity NPC86774
0.8417 Intermediate Similarity NPC470856
0.8417 Intermediate Similarity NPC28337
0.8414 Intermediate Similarity NPC285623
0.8409 Intermediate Similarity NPC473744
0.8403 Intermediate Similarity NPC472421
0.8394 Intermediate Similarity NPC470397
0.8394 Intermediate Similarity NPC156910
0.8387 Intermediate Similarity NPC252004
0.8385 Intermediate Similarity NPC184219
0.8385 Intermediate Similarity NPC221798
0.8382 Intermediate Similarity NPC125920
0.838 Intermediate Similarity NPC51641
0.838 Intermediate Similarity NPC472629
0.838 Intermediate Similarity NPC300267
0.837 Intermediate Similarity NPC66158
0.8369 Intermediate Similarity NPC68104
0.8369 Intermediate Similarity NPC91560
0.8369 Intermediate Similarity NPC469385
0.8369 Intermediate Similarity NPC39329
0.8369 Intermediate Similarity NPC221432
0.8369 Intermediate Similarity NPC310130
0.8369 Intermediate Similarity NPC257097
0.8369 Intermediate Similarity NPC164980
0.8369 Intermediate Similarity NPC75049
0.8369 Intermediate Similarity NPC169591
0.8369 Intermediate Similarity NPC225884
0.8369 Intermediate Similarity NPC143896
0.8369 Intermediate Similarity NPC149026
0.8369 Intermediate Similarity NPC175504
0.8369 Intermediate Similarity NPC150408
0.8361 Intermediate Similarity NPC183648
0.8358 Intermediate Similarity NPC473982
0.8357 Intermediate Similarity NPC3188
0.8357 Intermediate Similarity NPC213322
0.8357 Intermediate Similarity NPC312391
0.8357 Intermediate Similarity NPC4743
0.8357 Intermediate Similarity NPC470087
0.8357 Intermediate Similarity NPC321980
0.8357 Intermediate Similarity NPC324386
0.8345 Intermediate Similarity NPC472580
0.8345 Intermediate Similarity NPC471697
0.8345 Intermediate Similarity NPC473076
0.8345 Intermediate Similarity NPC23257
0.8345 Intermediate Similarity NPC470211
0.8333 Intermediate Similarity NPC476480
0.8333 Intermediate Similarity NPC84585
0.8333 Intermediate Similarity NPC98395
0.8333 Intermediate Similarity NPC121104
0.8322 Intermediate Similarity NPC130581
0.8322 Intermediate Similarity NPC12148
0.8321 Intermediate Similarity NPC64157
0.8321 Intermediate Similarity NPC278832
0.8321 Intermediate Similarity NPC165556
0.831 Intermediate Similarity NPC470890
0.831 Intermediate Similarity NPC474044
0.831 Intermediate Similarity NPC224714
0.831 Intermediate Similarity NPC473013
0.831 Intermediate Similarity NPC236766
0.831 Intermediate Similarity NPC473015
0.831 Intermediate Similarity NPC209040
0.831 Intermediate Similarity NPC197252
0.8309 Intermediate Similarity NPC108113
0.8309 Intermediate Similarity NPC93756
0.8309 Intermediate Similarity NPC223457
0.8309 Intermediate Similarity NPC27643
0.8306 Intermediate Similarity NPC242136
0.8298 Intermediate Similarity NPC228504
0.8298 Intermediate Similarity NPC161506
0.8298 Intermediate Similarity NPC10937
0.8298 Intermediate Similarity NPC220998
0.8298 Intermediate Similarity NPC125855
0.8298 Intermediate Similarity NPC223500
0.8298 Intermediate Similarity NPC148545
0.8298 Intermediate Similarity NPC107572
0.8298 Intermediate Similarity NPC194432
0.8298 Intermediate Similarity NPC158871
0.8298 Intermediate Similarity NPC53192
0.8298 Intermediate Similarity NPC265040
0.8298 Intermediate Similarity NPC40833
0.8298 Intermediate Similarity NPC177354
0.8298 Intermediate Similarity NPC66515
0.8298 Intermediate Similarity NPC306829
0.8298 Intermediate Similarity NPC167624
0.8298 Intermediate Similarity NPC148757
0.8298 Intermediate Similarity NPC227579
0.8298 Intermediate Similarity NPC76338
0.8298 Intermediate Similarity NPC324134
0.8298 Intermediate Similarity NPC76372
0.8298 Intermediate Similarity NPC324436
0.8298 Intermediate Similarity NPC78
0.8298 Intermediate Similarity NPC166482
0.8298 Intermediate Similarity NPC328164
0.8298 Intermediate Similarity NPC1089
0.8298 Intermediate Similarity NPC37496
0.8298 Intermediate Similarity NPC166934
0.8298 Intermediate Similarity NPC147145
0.8298 Intermediate Similarity NPC64915
0.8298 Intermediate Similarity NPC182852
0.8298 Intermediate Similarity NPC296917
0.8298 Intermediate Similarity NPC32739
0.8288 Intermediate Similarity NPC473996
0.8288 Intermediate Similarity NPC477957
0.8288 Intermediate Similarity NPC476238
0.8288 Intermediate Similarity NPC31627
0.8288 Intermediate Similarity NPC327269
0.8286 Intermediate Similarity NPC471587
0.8276 Intermediate Similarity NPC321896
0.8276 Intermediate Similarity NPC61258
0.8276 Intermediate Similarity NPC476185
0.8273 Intermediate Similarity NPC473988
0.8273 Intermediate Similarity NPC124269
0.8273 Intermediate Similarity NPC472460
0.8273 Intermediate Similarity NPC329225
0.8273 Intermediate Similarity NPC147686
0.8273 Intermediate Similarity NPC131130
0.8271 Intermediate Similarity NPC186098
0.8271 Intermediate Similarity NPC80694
0.8264 Intermediate Similarity NPC135325
0.8264 Intermediate Similarity NPC6511
0.8261 Intermediate Similarity NPC29638
0.8261 Intermediate Similarity NPC187826
0.8261 Intermediate Similarity NPC470398
0.8261 Intermediate Similarity NPC240593
0.8261 Intermediate Similarity NPC222633
0.8261 Intermediate Similarity NPC174999
0.8261 Intermediate Similarity NPC24394
0.8258 Intermediate Similarity NPC475236
0.8254 Intermediate Similarity NPC470860
0.8252 Intermediate Similarity NPC210826
0.8248 Intermediate Similarity NPC144027
0.8248 Intermediate Similarity NPC236974
0.8239 Intermediate Similarity NPC301751
0.8239 Intermediate Similarity NPC223812
0.8239 Intermediate Similarity NPC81697
0.8239 Intermediate Similarity NPC278249
0.8239 Intermediate Similarity NPC255133
0.8239 Intermediate Similarity NPC166138
0.8239 Intermediate Similarity NPC213900
0.8239 Intermediate Similarity NPC77794
0.8239 Intermediate Similarity NPC476178
0.8239 Intermediate Similarity NPC185276
0.8239 Intermediate Similarity NPC51887
0.8239 Intermediate Similarity NPC18585
0.8239 Intermediate Similarity NPC478086

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC939 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
0.8345 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD2344 Approved
0.8306 Intermediate Similarity NPD1241 Discontinued
0.8273 Intermediate Similarity NPD1549 Phase 2
0.8201 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.8201 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.8162 Intermediate Similarity NPD1240 Approved
0.8154 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.8129 Intermediate Similarity NPD2796 Approved
0.8099 Intermediate Similarity NPD2309 Approved
0.8092 Intermediate Similarity NPD9717 Approved
0.8071 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.8058 Intermediate Similarity NPD2799 Discontinued
0.8058 Intermediate Similarity NPD1510 Phase 2
0.8056 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.8043 Intermediate Similarity NPD1607 Approved
0.8028 Intermediate Similarity NPD4628 Phase 3
0.7984 Intermediate Similarity NPD9545 Approved
0.7958 Intermediate Similarity NPD1243 Approved
0.7917 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7905 Intermediate Similarity NPD4380 Phase 2
0.7883 Intermediate Similarity NPD2313 Discontinued
0.7872 Intermediate Similarity NPD2935 Discontinued
0.7867 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7867 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7852 Intermediate Similarity NPD7411 Suspended
0.7832 Intermediate Similarity NPD2800 Approved
0.7829 Intermediate Similarity NPD7075 Discontinued
0.7823 Intermediate Similarity NPD920 Approved
0.782 Intermediate Similarity NPD3972 Approved
0.7815 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7808 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7808 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.78 Intermediate Similarity NPD6801 Discontinued
0.7794 Intermediate Similarity NPD9494 Approved
0.7778 Intermediate Similarity NPD1203 Approved
0.7762 Intermediate Similarity NPD2424 Discontinued
0.7748 Intermediate Similarity NPD7819 Suspended
0.7704 Intermediate Similarity NPD1876 Approved
0.7692 Intermediate Similarity NPD6006 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD6004 Phase 3
0.7692 Intermediate Similarity NPD6002 Phase 3
0.7692 Intermediate Similarity NPD6003 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD6005 Phase 3
0.7692 Intermediate Similarity NPD9493 Approved
0.7682 Intermediate Similarity NPD1934 Approved
0.768 Intermediate Similarity NPD290 Approved
0.7676 Intermediate Similarity NPD4308 Phase 3
0.7655 Intermediate Similarity NPD3750 Approved
0.7652 Intermediate Similarity NPD4196 Clinical (unspecified phase)
0.7647 Intermediate Similarity NPD2797 Approved
0.7647 Intermediate Similarity NPD3882 Suspended
0.7643 Intermediate Similarity NPD3140 Approved
0.7643 Intermediate Similarity NPD3142 Approved
0.7635 Intermediate Similarity NPD6273 Approved
0.7626 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7626 Intermediate Similarity NPD3268 Approved
0.7626 Intermediate Similarity NPD411 Approved
0.7619 Intermediate Similarity NPD6799 Approved
0.7609 Intermediate Similarity NPD6832 Phase 2
0.76 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.76 Intermediate Similarity NPD7458 Discontinued
0.7597 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7591 Intermediate Similarity NPD1019 Discontinued
0.7591 Intermediate Similarity NPD2798 Approved
0.7589 Intermediate Similarity NPD447 Suspended
0.7589 Intermediate Similarity NPD6355 Discontinued
0.7569 Intermediate Similarity NPD1471 Phase 3
0.7569 Intermediate Similarity NPD2346 Discontinued
0.7568 Intermediate Similarity NPD2534 Approved
0.7568 Intermediate Similarity NPD2532 Approved
0.7568 Intermediate Similarity NPD2533 Approved
0.7556 Intermediate Similarity NPD1608 Approved
0.7552 Intermediate Similarity NPD7033 Discontinued
0.7534 Intermediate Similarity NPD7003 Approved
0.7517 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD4477 Approved
0.75 Intermediate Similarity NPD4476 Approved
0.75 Intermediate Similarity NPD6798 Discontinued
0.75 Intermediate Similarity NPD1511 Approved
0.75 Intermediate Similarity NPD5494 Approved
0.75 Intermediate Similarity NPD1551 Phase 2
0.748 Intermediate Similarity NPD2684 Approved
0.7468 Intermediate Similarity NPD2296 Approved
0.7463 Intermediate Similarity NPD1778 Approved
0.7463 Intermediate Similarity NPD4626 Approved
0.7445 Intermediate Similarity NPD1283 Approved
0.7444 Intermediate Similarity NPD1894 Discontinued
0.7438 Intermediate Similarity NPD3818 Discontinued
0.7436 Intermediate Similarity NPD919 Approved
0.7434 Intermediate Similarity NPD6599 Discontinued
0.7431 Intermediate Similarity NPD3748 Approved
0.7421 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7419 Intermediate Similarity NPD7768 Phase 2
0.7415 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.74 Intermediate Similarity NPD1512 Approved
0.7394 Intermediate Similarity NPD4307 Phase 2
0.7391 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7391 Intermediate Similarity NPD5844 Phase 1
0.7391 Intermediate Similarity NPD3266 Approved
0.7391 Intermediate Similarity NPD3267 Approved
0.7388 Intermediate Similarity NPD5691 Approved
0.7388 Intermediate Similarity NPD1651 Approved
0.7372 Intermediate Similarity NPD3749 Approved
0.7368 Intermediate Similarity NPD3226 Approved
0.7365 Intermediate Similarity NPD3887 Approved
0.7365 Intermediate Similarity NPD2354 Approved
0.7362 Intermediate Similarity NPD6559 Discontinued
0.7353 Intermediate Similarity NPD422 Phase 1
0.7343 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD6959 Discontinued
0.7342 Intermediate Similarity NPD1247 Approved
0.7338 Intermediate Similarity NPD6280 Approved
0.7338 Intermediate Similarity NPD3690 Phase 2
0.7338 Intermediate Similarity NPD3691 Phase 2
0.7338 Intermediate Similarity NPD6279 Approved
0.7333 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7333 Intermediate Similarity NPD17 Approved
0.7333 Intermediate Similarity NPD4661 Approved
0.7333 Intermediate Similarity NPD4662 Approved
0.7317 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD4575 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD6166 Phase 2
0.7308 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7301 Intermediate Similarity NPD3823 Discontinued
0.7299 Intermediate Similarity NPD1481 Phase 2
0.7292 Intermediate Similarity NPD6651 Approved
0.729 Intermediate Similarity NPD2801 Approved
0.7285 Intermediate Similarity NPD5049 Phase 3
0.7279 Intermediate Similarity NPD3496 Discontinued
0.7266 Intermediate Similarity NPD9265 Clinical (unspecified phase)
0.7266 Intermediate Similarity NPD1164 Approved
0.7254 Intermediate Similarity NPD3764 Approved
0.7252 Intermediate Similarity NPD7843 Approved
0.7239 Intermediate Similarity NPD1729 Discontinued
0.7237 Intermediate Similarity NPD5403 Approved
0.7226 Intermediate Similarity NPD7577 Discontinued
0.7226 Intermediate Similarity NPD1535 Discovery
0.7226 Intermediate Similarity NPD1610 Phase 2
0.7226 Intermediate Similarity NPD1281 Approved
0.7222 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD230 Phase 1
0.7222 Intermediate Similarity NPD5124 Phase 1
0.7219 Intermediate Similarity NPD5401 Approved
0.7218 Intermediate Similarity NPD7157 Approved
0.7214 Intermediate Similarity NPD5647 Approved
0.7211 Intermediate Similarity NPD2355 Clinical (unspecified phase)
0.7211 Intermediate Similarity NPD2353 Approved
0.7203 Intermediate Similarity NPD6233 Phase 2
0.7195 Intermediate Similarity NPD5953 Discontinued
0.7194 Intermediate Similarity NPD3225 Approved
0.7188 Intermediate Similarity NPD3134 Approved
0.7188 Intermediate Similarity NPD6808 Phase 2
0.7185 Intermediate Similarity NPD1548 Phase 1
0.7165 Intermediate Similarity NPD1237 Approved
0.7163 Intermediate Similarity NPD454 Approved
0.7153 Intermediate Similarity NPD4060 Phase 1
0.7152 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD6099 Approved
0.7143 Intermediate Similarity NPD2649 Approved
0.7143 Intermediate Similarity NPD6100 Approved
0.7143 Intermediate Similarity NPD2651 Approved
0.7134 Intermediate Similarity NPD3817 Phase 2
0.7134 Intermediate Similarity NPD7074 Phase 3
0.7133 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7133 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7132 Intermediate Similarity NPD9264 Approved
0.7132 Intermediate Similarity NPD9267 Approved
0.7132 Intermediate Similarity NPD1358 Approved
0.7132 Intermediate Similarity NPD9263 Approved
0.7121 Intermediate Similarity NPD821 Approved
0.7117 Intermediate Similarity NPD7893 Clinical (unspecified phase)
0.7115 Intermediate Similarity NPD6844 Discontinued
0.7114 Intermediate Similarity NPD2654 Approved
0.7109 Intermediate Similarity NPD9697 Approved
0.7103 Intermediate Similarity NPD1933 Approved
0.7099 Intermediate Similarity NPD2181 Clinical (unspecified phase)
0.709 Intermediate Similarity NPD6671 Approved
0.7086 Intermediate Similarity NPD7440 Discontinued
0.7083 Intermediate Similarity NPD4062 Phase 3
0.7077 Intermediate Similarity NPD74 Approved
0.7077 Intermediate Similarity NPD9266 Approved
0.7075 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7073 Intermediate Similarity NPD7054 Approved
0.7073 Intermediate Similarity NPD7286 Phase 2
0.707 Intermediate Similarity NPD5760 Phase 2
0.707 Intermediate Similarity NPD5761 Phase 2
0.7067 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD6653 Approved
0.7054 Intermediate Similarity NPD968 Approved
0.7045 Intermediate Similarity NPD1609 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD2861 Phase 2
0.7037 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7034 Intermediate Similarity NPD943 Approved
0.7034 Intermediate Similarity NPD4140 Approved
0.703 Intermediate Similarity NPD7472 Approved
0.7025 Intermediate Similarity NPD5402 Approved
0.7021 Intermediate Similarity NPD6362 Approved

Structure

External Identifiers

PubChem CID   10262829
ChEMBL   CHEMBL390376
ZINC  

Physicochemical Properties

Molecular Weight:  218.09
ALogP:  -0.3328
MLogP:  2.56
XLogP:  1.223
# Rotatable Bonds:  5
Polar Surface Area:  46.53
# H-Bond Aceptor:  2
# H-Bond Donor:  1
# Rings:  2
# Heavy Atoms:  16

Download Data

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