Natural Product: NPC160843

Natural Product ID:  NPC160843
Common Name:   Stoloniferone F
IUPAC Name:   (2R,5R,6R,8S,9S,10R,11R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-2,5,6,11-tetrahydroxy-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydro-2H-cyclopenta[a]phenanthren-1-one
Synonyms:   stoloniferone F
Molecular Formula:   C28H46O5
Standard InCHIKey:  MCEHIUSRVOSOFI-PPEGKMTJSA-N
Standard InCHI:  InChI=1S/C28H46O5/c1-15(2)16(3)7-8-17(4)19-9-10-20-18-13-23(31)28(33)12-11-21(29)25(32)27(28,6)24(18)22(30)14-26(19,20)5/h11-12,15-24,29-31,33H,7-10,13-14H2,1-6H3/t16-,17+,18-,19+,20-,21+,22+,23+,24+,26+,27-,28-/m0/s1
Canonical SMILES:  C[C@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)C[C@@H](O)[C@H]1[C@H]2C[C@H]([C@@]2([C@]1(C)C(=O)[C@H](O)C=C2)O)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
NPO3077 Clavularia viridis Species Clavulariidae Eukaryota PMID[12444673]
NPO33409 clavularia violacea Species Clavulariidae Eukaryota PMID[12444673]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT168 Cell Line P388 Mus musculus ED50 = 2.36 ug/ml 17371822
NPT81 Cell Line A549 Homo sapiens ED50 = 3.69 ug/ml 17371822
NPT139 Cell Line HT-29 Homo sapiens ED50 = 6.46 ug/ml 17371822

  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 NPC160843 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
0.9897 High Similarity NPC166607
0.8911 High Similarity NPC249187
0.8911 High Similarity NPC247957
0.8835 High Similarity NPC475060
0.8835 High Similarity NPC220229
0.875 High Similarity NPC217201
0.8738 High Similarity NPC214264
0.8738 High Similarity NPC152695
0.8738 High Similarity NPC149047
0.8738 High Similarity NPC49958
0.8738 High Similarity NPC202167
0.8738 High Similarity NPC257353
0.8738 High Similarity NPC85829
0.8738 High Similarity NPC48733
0.8738 High Similarity NPC476027
0.8738 High Similarity NPC50692
0.8738 High Similarity NPC171137
0.8738 High Similarity NPC296945
0.8738 High Similarity NPC97202
0.8738 High Similarity NPC260268
0.8738 High Similarity NPC150531
0.8738 High Similarity NPC302607
0.8738 High Similarity NPC319077
0.8725 High Similarity NPC191892
0.8692 High Similarity NPC108721
0.8692 High Similarity NPC73300
0.8667 High Similarity NPC11710
0.8667 High Similarity NPC214644
0.8654 High Similarity NPC83744
0.8641 High Similarity NPC209502
0.8641 High Similarity NPC72255
0.8641 High Similarity NPC204833
0.8614 High Similarity NPC154072
0.8586 High Similarity NPC472485
0.8586 High Similarity NPC271195
0.8571 High Similarity NPC329417
0.8544 High Similarity NPC117185
0.8491 Intermediate Similarity NPC87335
0.8485 Intermediate Similarity NPC196485
0.8485 Intermediate Similarity NPC292793
0.8485 Intermediate Similarity NPC245972
0.8476 Intermediate Similarity NPC165873
0.8476 Intermediate Similarity NPC477916
0.8454 Intermediate Similarity NPC32830
0.8454 Intermediate Similarity NPC474245
0.8447 Intermediate Similarity NPC477915
0.84 Intermediate Similarity NPC53565
0.8396 Intermediate Similarity NPC472218
0.8396 Intermediate Similarity NPC472217
0.8396 Intermediate Similarity NPC472219
0.8381 Intermediate Similarity NPC323834
0.8351 Intermediate Similarity NPC474668
0.8351 Intermediate Similarity NPC133588
0.8333 Intermediate Similarity NPC191565
0.8333 Intermediate Similarity NPC103051
0.8302 Intermediate Similarity NPC472925
0.83 Intermediate Similarity NPC8993
0.8283 Intermediate Similarity NPC41554
0.8283 Intermediate Similarity NPC97404
0.8283 Intermediate Similarity NPC475806
0.8276 Intermediate Similarity NPC470882
0.8273 Intermediate Similarity NPC147912
0.8273 Intermediate Similarity NPC67259
0.8269 Intermediate Similarity NPC477054
0.8257 Intermediate Similarity NPC207251
0.8252 Intermediate Similarity NPC15390
0.8252 Intermediate Similarity NPC110149
0.8252 Intermediate Similarity NPC327431
0.8241 Intermediate Similarity NPC76084
0.8241 Intermediate Similarity NPC235077
0.8235 Intermediate Similarity NPC474938
0.8235 Intermediate Similarity NPC126815
0.8235 Intermediate Similarity NPC170978
0.8235 Intermediate Similarity NPC474785
0.8224 Intermediate Similarity NPC65941
0.8218 Intermediate Similarity NPC272617
0.82 Intermediate Similarity NPC474736
0.82 Intermediate Similarity NPC109305
0.819 Intermediate Similarity NPC475050
0.819 Intermediate Similarity NPC311612
0.8182 Intermediate Similarity NPC329596
0.8182 Intermediate Similarity NPC48010
0.8182 Intermediate Similarity NPC3345
0.8182 Intermediate Similarity NPC204188
0.8182 Intermediate Similarity NPC136801
0.8182 Intermediate Similarity NPC250109
0.8182 Intermediate Similarity NPC80561
0.8182 Intermediate Similarity NPC962
0.8182 Intermediate Similarity NPC291484
0.8182 Intermediate Similarity NPC11216
0.8182 Intermediate Similarity NPC317210
0.8173 Intermediate Similarity NPC477051
0.8173 Intermediate Similarity NPC476897
0.8173 Intermediate Similarity NPC477052
0.8173 Intermediate Similarity NPC477053
0.8165 Intermediate Similarity NPC472928
0.8163 Intermediate Similarity NPC470417
0.8163 Intermediate Similarity NPC193360
0.8158 Intermediate Similarity NPC67569
0.8148 Intermediate Similarity NPC173905
0.8148 Intermediate Similarity NPC5475
0.8148 Intermediate Similarity NPC141350
0.8148 Intermediate Similarity NPC284828
0.8148 Intermediate Similarity NPC472216
0.8144 Intermediate Similarity NPC470955
0.8144 Intermediate Similarity NPC51014
0.8144 Intermediate Similarity NPC261266
0.8137 Intermediate Similarity NPC117133
0.8137 Intermediate Similarity NPC49371
0.8137 Intermediate Similarity NPC249954
0.8131 Intermediate Similarity NPC185
0.8125 Intermediate Similarity NPC471854
0.812 Intermediate Similarity NPC473253
0.812 Intermediate Similarity NPC473265
0.8119 Intermediate Similarity NPC196227
0.8119 Intermediate Similarity NPC111015
0.8113 Intermediate Similarity NPC201763
0.8113 Intermediate Similarity NPC284865
0.8108 Intermediate Similarity NPC326542
0.81 Intermediate Similarity NPC155304
0.81 Intermediate Similarity NPC233116
0.81 Intermediate Similarity NPC116726
0.81 Intermediate Similarity NPC73457
0.81 Intermediate Similarity NPC473998
0.81 Intermediate Similarity NPC189520
0.8095 Intermediate Similarity NPC473424
0.8095 Intermediate Similarity NPC87351
0.8091 Intermediate Similarity NPC280782
0.8087 Intermediate Similarity NPC23786
0.8087 Intermediate Similarity NPC470265
0.8087 Intermediate Similarity NPC222688
0.8087 Intermediate Similarity NPC269642
0.8081 Intermediate Similarity NPC473999
0.8081 Intermediate Similarity NPC472970
0.8081 Intermediate Similarity NPC472971
0.8081 Intermediate Similarity NPC2983
0.8081 Intermediate Similarity NPC470361
0.8081 Intermediate Similarity NPC469319
0.8081 Intermediate Similarity NPC229871
0.8081 Intermediate Similarity NPC309603
0.8081 Intermediate Similarity NPC76879
0.807 Intermediate Similarity NPC109973
0.8061 Intermediate Similarity NPC90652
0.8061 Intermediate Similarity NPC138756
0.8058 Intermediate Similarity NPC190554
0.8058 Intermediate Similarity NPC320306
0.8058 Intermediate Similarity NPC108078
0.8058 Intermediate Similarity NPC107243
0.8058 Intermediate Similarity NPC291634
0.8053 Intermediate Similarity NPC50774
0.8053 Intermediate Similarity NPC709
0.8041 Intermediate Similarity NPC471224
0.8039 Intermediate Similarity NPC259286
0.8039 Intermediate Similarity NPC200702
0.8037 Intermediate Similarity NPC475494
0.8036 Intermediate Similarity NPC266728
0.8036 Intermediate Similarity NPC270929
0.8036 Intermediate Similarity NPC179626
0.8036 Intermediate Similarity NPC49492
0.8034 Intermediate Similarity NPC293112
0.802 Intermediate Similarity NPC474807
0.8019 Intermediate Similarity NPC131366
0.8017 Intermediate Similarity NPC469789
0.8 Intermediate Similarity NPC302537
0.8 Intermediate Similarity NPC163372
0.8 Intermediate Similarity NPC320026
0.8 Intermediate Similarity NPC46758
0.7983 Intermediate Similarity NPC470880
0.7982 Intermediate Similarity NPC475041
0.7982 Intermediate Similarity NPC473270
0.7982 Intermediate Similarity NPC61520
0.7981 Intermediate Similarity NPC477854
0.798 Intermediate Similarity NPC471791
0.798 Intermediate Similarity NPC53911
0.798 Intermediate Similarity NPC328313
0.798 Intermediate Similarity NPC471793
0.7965 Intermediate Similarity NPC167606
0.7965 Intermediate Similarity NPC140055
0.7965 Intermediate Similarity NPC286528
0.7965 Intermediate Similarity NPC20302
0.7965 Intermediate Similarity NPC470775
0.7965 Intermediate Similarity NPC176513
0.7963 Intermediate Similarity NPC43285
0.7963 Intermediate Similarity NPC58370
0.7963 Intermediate Similarity NPC64844
0.7963 Intermediate Similarity NPC473284
0.7963 Intermediate Similarity NPC42847
0.7963 Intermediate Similarity NPC230541
0.7961 Intermediate Similarity NPC477853
0.7961 Intermediate Similarity NPC288970
0.7961 Intermediate Similarity NPC471463
0.7961 Intermediate Similarity NPC235053
0.7959 Intermediate Similarity NPC6391
0.7959 Intermediate Similarity NPC299068
0.7949 Intermediate Similarity NPC473255
0.7949 Intermediate Similarity NPC8374
0.7946 Intermediate Similarity NPC117712
0.7944 Intermediate Similarity NPC75531
0.7944 Intermediate Similarity NPC29705
0.7944 Intermediate Similarity NPC474281

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC160843 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
0.8241 Intermediate Similarity NPD4634 Approved
0.8095 Intermediate Similarity NPD5211 Phase 2
0.7965 Intermediate Similarity NPD7115 Discovery
0.7944 Intermediate Similarity NPD5141 Approved
0.7938 Intermediate Similarity NPD4786 Approved
0.7905 Intermediate Similarity NPD5286 Approved
0.7905 Intermediate Similarity NPD4696 Approved
0.7905 Intermediate Similarity NPD5285 Approved
0.7885 Intermediate Similarity NPD4755 Approved
0.783 Intermediate Similarity NPD5223 Approved
0.7788 Intermediate Similarity NPD5220 Clinical (unspecified phase)
0.7788 Intermediate Similarity NPD5222 Approved
0.7788 Intermediate Similarity NPD4697 Phase 3
0.7788 Intermediate Similarity NPD5221 Approved
0.7778 Intermediate Similarity NPD3618 Phase 1
0.7757 Intermediate Similarity NPD5224 Approved
0.7757 Intermediate Similarity NPD5225 Approved
0.7757 Intermediate Similarity NPD5226 Approved
0.7757 Intermediate Similarity NPD4633 Approved
0.7745 Intermediate Similarity NPD6079 Approved
0.7736 Intermediate Similarity NPD4700 Approved
0.7732 Intermediate Similarity NPD3667 Approved
0.7723 Intermediate Similarity NPD5328 Approved
0.7714 Intermediate Similarity NPD5173 Approved
0.7699 Intermediate Similarity NPD4632 Approved
0.7685 Intermediate Similarity NPD5175 Approved
0.7685 Intermediate Similarity NPD5174 Approved
0.767 Intermediate Similarity NPD4202 Approved
0.767 Intermediate Similarity NPD6399 Phase 3
0.7607 Intermediate Similarity NPD6319 Approved
0.7607 Intermediate Similarity NPD6054 Approved
0.7568 Intermediate Similarity NPD6899 Approved
0.7568 Intermediate Similarity NPD5345 Clinical (unspecified phase)
0.7568 Intermediate Similarity NPD6881 Approved
0.7549 Intermediate Similarity NPD4753 Phase 2
0.7545 Intermediate Similarity NPD5739 Approved
0.7545 Intermediate Similarity NPD6675 Approved
0.7545 Intermediate Similarity NPD6402 Approved
0.7545 Intermediate Similarity NPD7128 Approved
0.7524 Intermediate Similarity NPD5210 Approved
0.7524 Intermediate Similarity NPD4629 Approved
0.7523 Intermediate Similarity NPD4754 Approved
0.7522 Intermediate Similarity NPD6650 Approved
0.7522 Intermediate Similarity NPD6649 Approved
0.75 Intermediate Similarity NPD6372 Approved
0.75 Intermediate Similarity NPD6373 Approved
0.7479 Intermediate Similarity NPD6370 Approved
0.7477 Intermediate Similarity NPD5697 Approved
0.7458 Intermediate Similarity NPD6059 Approved
0.7456 Intermediate Similarity NPD8297 Approved
0.7434 Intermediate Similarity NPD6883 Approved
0.7434 Intermediate Similarity NPD7290 Approved
0.7434 Intermediate Similarity NPD7102 Approved
0.7426 Intermediate Similarity NPD3574 Clinical (unspecified phase)
0.7411 Intermediate Similarity NPD7320 Approved
0.7411 Intermediate Similarity NPD4730 Approved
0.7411 Intermediate Similarity NPD6011 Approved
0.7411 Intermediate Similarity NPD4729 Approved
0.7395 Intermediate Similarity NPD6015 Approved
0.7395 Intermediate Similarity NPD6016 Approved
0.7387 Intermediate Similarity NPD4767 Approved
0.7387 Intermediate Similarity NPD4768 Approved
0.7368 Intermediate Similarity NPD6847 Approved
0.7368 Intermediate Similarity NPD8130 Phase 1
0.7368 Intermediate Similarity NPD6617 Approved
0.7368 Intermediate Similarity NPD6869 Approved
0.7355 Intermediate Similarity NPD7492 Approved
0.735 Intermediate Similarity NPD6009 Approved
0.7347 Intermediate Similarity NPD7525 Registered
0.7345 Intermediate Similarity NPD6014 Approved
0.7345 Intermediate Similarity NPD6013 Approved
0.7345 Intermediate Similarity NPD6012 Approved
0.7333 Intermediate Similarity NPD5988 Approved
0.7327 Intermediate Similarity NPD5329 Approved
0.7321 Intermediate Similarity NPD5701 Approved
0.7304 Intermediate Similarity NPD6882 Approved
0.7295 Intermediate Similarity NPD6616 Approved
0.7281 Intermediate Similarity NPD5248 Approved
0.7281 Intermediate Similarity NPD5247 Approved
0.7281 Intermediate Similarity NPD5134 Clinical (unspecified phase)
0.7281 Intermediate Similarity NPD5249 Phase 3
0.7281 Intermediate Similarity NPD5169 Approved
0.7281 Intermediate Similarity NPD5250 Approved
0.7281 Intermediate Similarity NPD5251 Approved
0.7281 Intermediate Similarity NPD5135 Approved
0.7257 Intermediate Similarity NPD5128 Approved
0.7255 Intermediate Similarity NPD5279 Phase 3
0.7248 Intermediate Similarity NPD7640 Approved
0.7248 Intermediate Similarity NPD7639 Approved
0.7236 Intermediate Similarity NPD7078 Approved
0.7228 Intermediate Similarity NPD3133 Approved
0.7228 Intermediate Similarity NPD3665 Phase 1
0.7228 Intermediate Similarity NPD3666 Approved
0.7228 Intermediate Similarity NPD4197 Approved
0.7228 Intermediate Similarity NPD3668 Phase 3
0.7227 Intermediate Similarity NPD4522 Approved
0.7222 Intermediate Similarity NPD6083 Phase 2
0.7222 Intermediate Similarity NPD6084 Phase 2
0.7217 Intermediate Similarity NPD5215 Approved
0.7217 Intermediate Similarity NPD5127 Approved
0.7217 Intermediate Similarity NPD6401 Clinical (unspecified phase)
0.7217 Intermediate Similarity NPD5216 Approved
0.7217 Intermediate Similarity NPD5217 Approved
0.7184 Intermediate Similarity NPD4751 Clinical (unspecified phase)
0.7177 Intermediate Similarity NPD7736 Approved
0.7156 Intermediate Similarity NPD7638 Approved
0.7131 Intermediate Similarity NPD7604 Phase 2
0.7107 Intermediate Similarity NPD5983 Phase 2
0.7105 Intermediate Similarity NPD5168 Approved
0.7097 Intermediate Similarity NPD8293 Discontinued
0.7087 Intermediate Similarity NPD5690 Phase 2
0.708 Intermediate Similarity NPD6008 Approved
0.7075 Intermediate Similarity NPD7515 Phase 2
0.7075 Intermediate Similarity NPD7637 Suspended
0.704 Intermediate Similarity NPD6033 Approved
0.7034 Intermediate Similarity NPD5167 Approved
0.703 Intermediate Similarity NPD4269 Approved
0.703 Intermediate Similarity NPD4223 Phase 3
0.703 Intermediate Similarity NPD4270 Approved
0.703 Intermediate Similarity NPD4221 Approved
0.7019 Intermediate Similarity NPD7524 Approved
0.7018 Intermediate Similarity NPD6412 Phase 2
0.7016 Intermediate Similarity NPD6336 Discontinued
0.701 Intermediate Similarity NPD6942 Approved
0.701 Intermediate Similarity NPD7339 Approved
0.7 Intermediate Similarity NPD4225 Approved
0.7 Intermediate Similarity NPD6335 Approved
0.7 Intermediate Similarity NPD5696 Approved
0.699 Remote Similarity NPD7520 Clinical (unspecified phase)
0.697 Remote Similarity NPD5784 Clinical (unspecified phase)
0.6952 Remote Similarity NPD5737 Approved
0.6952 Remote Similarity NPD6672 Approved
0.6942 Remote Similarity NPD7100 Approved
0.6942 Remote Similarity NPD7101 Approved
0.6923 Remote Similarity NPD4694 Approved
0.6923 Remote Similarity NPD4623 Approved
0.6923 Remote Similarity NPD5280 Approved
0.6923 Remote Similarity NPD4519 Discontinued
0.6917 Remote Similarity NPD6317 Approved
0.6916 Remote Similarity NPD5281 Approved
0.6916 Remote Similarity NPD8034 Phase 2
0.6916 Remote Similarity NPD5284 Approved
0.6916 Remote Similarity NPD8035 Phase 2
0.6909 Remote Similarity NPD7902 Approved
0.6897 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6893 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6881 Remote Similarity NPD5695 Phase 3
0.686 Remote Similarity NPD6313 Approved
0.686 Remote Similarity NPD6314 Approved
0.6855 Remote Similarity NPD8328 Phase 3
0.6852 Remote Similarity NPD5779 Approved
0.6852 Remote Similarity NPD5778 Approved
0.685 Remote Similarity NPD7319 Approved
0.6833 Remote Similarity NPD6274 Approved
0.6833 Remote Similarity NPD6868 Approved
0.6832 Remote Similarity NPD7514 Phase 3
0.6832 Remote Similarity NPD4252 Approved
0.6832 Remote Similarity NPD6930 Phase 2
0.6832 Remote Similarity NPD4695 Discontinued
0.6832 Remote Similarity NPD6931 Approved
0.6829 Remote Similarity NPD6921 Approved
0.6829 Remote Similarity NPD6291 Clinical (unspecified phase)
0.6827 Remote Similarity NPD5363 Approved
0.6822 Remote Similarity NPD5785 Approved
0.68 Remote Similarity NPD6114 Approved
0.68 Remote Similarity NPD6115 Approved
0.68 Remote Similarity NPD6118 Approved
0.68 Remote Similarity NPD3617 Approved
0.68 Remote Similarity NPD6697 Approved
0.6796 Remote Similarity NPD4788 Approved
0.6796 Remote Similarity NPD6695 Phase 3
0.6789 Remote Similarity NPD7748 Approved
0.6789 Remote Similarity NPD5282 Discontinued
0.6777 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6768 Remote Similarity NPD6933 Approved
0.6768 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6765 Remote Similarity NPD5369 Approved
0.6762 Remote Similarity NPD5786 Approved
0.6762 Remote Similarity NPD4690 Approved
0.6762 Remote Similarity NPD4689 Approved
0.6762 Remote Similarity NPD5205 Approved
0.6762 Remote Similarity NPD4693 Phase 3
0.6762 Remote Similarity NPD4138 Approved
0.6762 Remote Similarity NPD4688 Approved
0.6762 Remote Similarity NPD6098 Approved
0.6752 Remote Similarity NPD8132 Clinical (unspecified phase)
0.6746 Remote Similarity NPD7507 Approved
0.6733 Remote Similarity NPD6929 Approved
0.6729 Remote Similarity NPD6673 Approved
0.6729 Remote Similarity NPD6080 Approved
0.6729 Remote Similarity NPD6904 Approved
0.6727 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6701 Remote Similarity NPD4808 Clinical (unspecified phase)
0.6701 Remote Similarity NPD4809 Clinical (unspecified phase)
0.67 Remote Similarity NPD6116 Phase 1
0.6695 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6694 Remote Similarity NPD6909 Approved
0.6694 Remote Similarity NPD6908 Approved
0.6667 Remote Similarity NPD7332 Phase 2
0.6667 Remote Similarity NPD7632 Discontinued

Structure

External Identifiers

PubChem CID   11081071
ChEMBL   CHEMBL483848
ZINC  

Physicochemical Properties

Molecular Weight:  462.33
ALogP:  0.1355
MLogP:  3.99
XLogP:  6.314
# Rotatable Bonds:  15
Polar Surface Area:  97.99
# H-Bond Aceptor:  5
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  33

Download Data

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Structure MOL file  
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Biological Activities  
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