Natural Product: NPC11711

Natural Product ID:  NPC11711
Common Name:   Ganoderenicacid F
IUPAC Name:   (E)-2-methyl-4-oxo-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3,7,11,15-tetraoxo-2,5,6,12,16,17-hexahydro-1H-cyclopenta[a]phenanthren-17-yl]hept-5-enoic acid
Synonyms:   Ganoderenicacid F
Molecular Formula:   C30H38O7
Standard InCHIKey:  QXLYRDZEWGVGFS-RUFHFYFVSA-N
Standard InCHI:  InChI=1S/C30H38O7/c1-15(10-17(31)11-16(2)26(36)37)18-12-23(35)30(7)25-19(32)13-21-27(3,4)22(34)8-9-28(21,5)24(25)20(33)14-29(18,30)6/h10,16,18,21H,8-9,11-14H2,1-7H3,(H,36,37)/b15-10+/t16?,18-,21+,28+,29-,30+/m1/s1
Canonical SMILES:  O=C(CC(C(=O)O)C)/C=C(/[C@H]1CC(=O)[C@@]2([C@]1(C)CC(=O)C1=C2C(=O)C[C@@H]2[C@]1(C)CCC(=O)C2(C)C)C)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
NPO7904 Ganoderma applanatum Species Ganodermataceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT165 Cell Line HeLa Homo sapiens IC50 = 202000 nM 23092389

  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 NPC11711 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
0.9383 High Similarity NPC209882
0.9268 High Similarity NPC311702
0.9268 High Similarity NPC123319
0.9268 High Similarity NPC94531
0.9036 High Similarity NPC8571
0.9036 High Similarity NPC473038
0.9024 High Similarity NPC168188
0.9024 High Similarity NPC470015
0.8902 High Similarity NPC133391
0.8902 High Similarity NPC320514
0.8795 High Similarity NPC469561
0.878 High Similarity NPC201912
0.878 High Similarity NPC38350
0.878 High Similarity NPC477372
0.869 High Similarity NPC320801
0.8675 High Similarity NPC142253
0.8675 High Similarity NPC3511
0.8675 High Similarity NPC260956
0.8605 High Similarity NPC136948
0.8588 High Similarity NPC29447
0.8587 High Similarity NPC51370
0.8571 High Similarity NPC69279
0.8571 High Similarity NPC271784
0.8571 High Similarity NPC83569
0.8554 High Similarity NPC147066
0.8537 High Similarity NPC477371
0.8471 Intermediate Similarity NPC87552
0.8462 Intermediate Similarity NPC472941
0.8462 Intermediate Similarity NPC456
0.8452 Intermediate Similarity NPC327969
0.8452 Intermediate Similarity NPC321289
0.8452 Intermediate Similarity NPC472239
0.8434 Intermediate Similarity NPC26139
0.8427 Intermediate Similarity NPC204341
0.8409 Intermediate Similarity NPC262043
0.8404 Intermediate Similarity NPC234892
0.8395 Intermediate Similarity NPC180886
0.8387 Intermediate Similarity NPC287833
0.8372 Intermediate Similarity NPC472940
0.8372 Intermediate Similarity NPC472931
0.8372 Intermediate Similarity NPC142649
0.8354 Intermediate Similarity NPC223187
0.8353 Intermediate Similarity NPC477373
0.8353 Intermediate Similarity NPC41539
0.8352 Intermediate Similarity NPC241156
0.8352 Intermediate Similarity NPC255809
0.8333 Intermediate Similarity NPC278459
0.8261 Intermediate Similarity NPC40765
0.8261 Intermediate Similarity NPC125622
0.8261 Intermediate Similarity NPC243525
0.8256 Intermediate Similarity NPC473246
0.8256 Intermediate Similarity NPC164577
0.825 Intermediate Similarity NPC321017
0.8235 Intermediate Similarity NPC472867
0.8235 Intermediate Similarity NPC240302
0.8222 Intermediate Similarity NPC297265
0.8211 Intermediate Similarity NPC293753
0.8202 Intermediate Similarity NPC473039
0.8202 Intermediate Similarity NPC54689
0.8193 Intermediate Similarity NPC74410
0.8182 Intermediate Similarity NPC96496
0.8172 Intermediate Similarity NPC43747
0.8172 Intermediate Similarity NPC106557
0.8161 Intermediate Similarity NPC60350
0.8152 Intermediate Similarity NPC171395
0.8152 Intermediate Similarity NPC37646
0.814 Intermediate Similarity NPC97913
0.8132 Intermediate Similarity NPC66429
0.8132 Intermediate Similarity NPC25750
0.8132 Intermediate Similarity NPC152897
0.8118 Intermediate Similarity NPC471898
0.8095 Intermediate Similarity NPC196827
0.8095 Intermediate Similarity NPC274996
0.8095 Intermediate Similarity NPC90965
0.8085 Intermediate Similarity NPC16021
0.8072 Intermediate Similarity NPC165711
0.8068 Intermediate Similarity NPC475022
0.8068 Intermediate Similarity NPC6247
0.8068 Intermediate Similarity NPC222613
0.8068 Intermediate Similarity NPC118648
0.8065 Intermediate Similarity NPC3772
0.8046 Intermediate Similarity NPC178025
0.8046 Intermediate Similarity NPC214043
0.8046 Intermediate Similarity NPC16287
0.8046 Intermediate Similarity NPC85774
0.8046 Intermediate Similarity NPC96095
0.8046 Intermediate Similarity NPC472865
0.8046 Intermediate Similarity NPC181743
0.8043 Intermediate Similarity NPC166906
0.8025 Intermediate Similarity NPC470044
0.8025 Intermediate Similarity NPC474228
0.8025 Intermediate Similarity NPC303613
0.8025 Intermediate Similarity NPC470045
0.8023 Intermediate Similarity NPC193347
0.8023 Intermediate Similarity NPC238991
0.8023 Intermediate Similarity NPC302661
0.8022 Intermediate Similarity NPC154101
0.8022 Intermediate Similarity NPC230064
0.8022 Intermediate Similarity NPC212301
0.8022 Intermediate Similarity NPC86266
0.8022 Intermediate Similarity NPC110657
0.8021 Intermediate Similarity NPC204450
0.8021 Intermediate Similarity NPC195290
0.8 Intermediate Similarity NPC159577
0.8 Intermediate Similarity NPC299971
0.8 Intermediate Similarity NPC477943
0.8 Intermediate Similarity NPC282593
0.8 Intermediate Similarity NPC157787
0.8 Intermediate Similarity NPC477973
0.8 Intermediate Similarity NPC260040
0.8 Intermediate Similarity NPC214387
0.8 Intermediate Similarity NPC144660
0.8 Intermediate Similarity NPC474570
0.8 Intermediate Similarity NPC88198
0.8 Intermediate Similarity NPC35734
0.8 Intermediate Similarity NPC307176
0.798 Intermediate Similarity NPC295244
0.7979 Intermediate Similarity NPC121339
0.7979 Intermediate Similarity NPC122294
0.7978 Intermediate Similarity NPC233836
0.7978 Intermediate Similarity NPC312215
0.7978 Intermediate Similarity NPC476409
0.7978 Intermediate Similarity NPC159046
0.7978 Intermediate Similarity NPC136548
0.7978 Intermediate Similarity NPC167877
0.7978 Intermediate Similarity NPC187376
0.7978 Intermediate Similarity NPC99909
0.7976 Intermediate Similarity NPC469996
0.7976 Intermediate Similarity NPC82635
0.7959 Intermediate Similarity NPC472935
0.7957 Intermediate Similarity NPC174948
0.7957 Intermediate Similarity NPC317586
0.7957 Intermediate Similarity NPC173875
0.7957 Intermediate Similarity NPC263347
0.7957 Intermediate Similarity NPC318282
0.7957 Intermediate Similarity NPC469995
0.7957 Intermediate Similarity NPC470016
0.7955 Intermediate Similarity NPC474537
0.7955 Intermediate Similarity NPC469948
0.7938 Intermediate Similarity NPC236390
0.7935 Intermediate Similarity NPC141497
0.7935 Intermediate Similarity NPC107674
0.7935 Intermediate Similarity NPC243866
0.7935 Intermediate Similarity NPC170220
0.7935 Intermediate Similarity NPC233118
0.7931 Intermediate Similarity NPC49019
0.7931 Intermediate Similarity NPC310470
0.7931 Intermediate Similarity NPC279639
0.7931 Intermediate Similarity NPC102197
0.7931 Intermediate Similarity NPC167103
0.7931 Intermediate Similarity NPC3856
0.7927 Intermediate Similarity NPC309852
0.7917 Intermediate Similarity NPC124211
0.7912 Intermediate Similarity NPC175628
0.7912 Intermediate Similarity NPC129913
0.7912 Intermediate Similarity NPC111585
0.7912 Intermediate Similarity NPC477149
0.7912 Intermediate Similarity NPC477147
0.7912 Intermediate Similarity NPC148414
0.7907 Intermediate Similarity NPC189237
0.7901 Intermediate Similarity NPC115023
0.7901 Intermediate Similarity NPC160817
0.7895 Intermediate Similarity NPC235464
0.7895 Intermediate Similarity NPC166745
0.7895 Intermediate Similarity NPC197386
0.7889 Intermediate Similarity NPC471722
0.7889 Intermediate Similarity NPC242864
0.7889 Intermediate Similarity NPC294480
0.7889 Intermediate Similarity NPC117122
0.7882 Intermediate Similarity NPC472490
0.7882 Intermediate Similarity NPC215843
0.7882 Intermediate Similarity NPC158846
0.7875 Intermediate Similarity NPC139397
0.7872 Intermediate Similarity NPC305483
0.7872 Intermediate Similarity NPC96859
0.7872 Intermediate Similarity NPC155676
0.7872 Intermediate Similarity NPC328162
0.7872 Intermediate Similarity NPC95565
0.7872 Intermediate Similarity NPC328371
0.7865 Intermediate Similarity NPC212843
0.7865 Intermediate Similarity NPC145879
0.7865 Intermediate Similarity NPC474732
0.7865 Intermediate Similarity NPC474778
0.7865 Intermediate Similarity NPC28252
0.7865 Intermediate Similarity NPC472869
0.7865 Intermediate Similarity NPC474733
0.7865 Intermediate Similarity NPC72133
0.7865 Intermediate Similarity NPC186975
0.7865 Intermediate Similarity NPC55309
0.7865 Intermediate Similarity NPC31564
0.7865 Intermediate Similarity NPC155011
0.7849 Intermediate Similarity NPC159410
0.7849 Intermediate Similarity NPC49670
0.7849 Intermediate Similarity NPC56525
0.7841 Intermediate Similarity NPC19849
0.7841 Intermediate Similarity NPC144258
0.7841 Intermediate Similarity NPC472864
0.7841 Intermediate Similarity NPC165064
0.7841 Intermediate Similarity NPC237712
0.7835 Intermediate Similarity NPC281702

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC11711 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
0.8427 Intermediate Similarity NPD5281 Approved
0.8427 Intermediate Similarity NPD5284 Approved
0.8148 Intermediate Similarity NPD5733 Approved
0.8132 Intermediate Similarity NPD6399 Phase 3
0.8085 Intermediate Similarity NPD5696 Approved
0.8023 Intermediate Similarity NPD4221 Approved
0.8023 Intermediate Similarity NPD4223 Phase 3
0.8 Intermediate Similarity NPD4747 Approved
0.7957 Intermediate Similarity NPD5695 Phase 3
0.7955 Intermediate Similarity NPD5329 Approved
0.7927 Intermediate Similarity NPD4687 Approved
0.7901 Intermediate Similarity NPD5276 Approved
0.7889 Intermediate Similarity NPD6672 Approved
0.7889 Intermediate Similarity NPD5737 Approved
0.7875 Intermediate Similarity NPD4137 Phase 3
0.7865 Intermediate Similarity NPD5280 Approved
0.7865 Intermediate Similarity NPD4694 Approved
0.7865 Intermediate Similarity NPD5690 Phase 2
0.7841 Intermediate Similarity NPD4197 Approved
0.7826 Intermediate Similarity NPD6050 Approved
0.7802 Intermediate Similarity NPD6673 Approved
0.7802 Intermediate Similarity NPD6080 Approved
0.7802 Intermediate Similarity NPD6904 Approved
0.7789 Intermediate Similarity NPD6084 Phase 2
0.7789 Intermediate Similarity NPD6083 Phase 2
0.7778 Intermediate Similarity NPD4691 Approved
0.7766 Intermediate Similarity NPD4629 Approved
0.7766 Intermediate Similarity NPD5210 Approved
0.7717 Intermediate Similarity NPD5692 Phase 3
0.7717 Intermediate Similarity NPD5207 Approved
0.7667 Intermediate Similarity NPD3618 Phase 1
0.7667 Intermediate Similarity NPD5205 Approved
0.7667 Intermediate Similarity NPD6409 Approved
0.7667 Intermediate Similarity NPD4690 Approved
0.7667 Intermediate Similarity NPD5279 Phase 3
0.7667 Intermediate Similarity NPD7521 Approved
0.7667 Intermediate Similarity NPD7334 Approved
0.7667 Intermediate Similarity NPD5330 Approved
0.7667 Intermediate Similarity NPD7146 Approved
0.7667 Intermediate Similarity NPD4693 Phase 3
0.7667 Intermediate Similarity NPD6684 Approved
0.7667 Intermediate Similarity NPD3574 Clinical (unspecified phase)
0.7667 Intermediate Similarity NPD4138 Approved
0.7667 Intermediate Similarity NPD4689 Approved
0.7667 Intermediate Similarity NPD4688 Approved
0.764 Intermediate Similarity NPD3133 Approved
0.764 Intermediate Similarity NPD3665 Phase 1
0.764 Intermediate Similarity NPD4786 Approved
0.764 Intermediate Similarity NPD3666 Approved
0.7634 Intermediate Similarity NPD5694 Approved
0.7609 Intermediate Similarity NPD4753 Phase 2
0.7609 Intermediate Similarity NPD7285 Clinical (unspecified phase)
0.7609 Intermediate Similarity NPD5328 Approved
0.7579 Intermediate Similarity NPD6356 Clinical (unspecified phase)
0.7558 Intermediate Similarity NPD3617 Approved
0.75 Intermediate Similarity NPD6903 Approved
0.75 Intermediate Similarity NPD4058 Approved
0.75 Intermediate Similarity NPD5208 Approved
0.75 Intermediate Similarity NPD7614 Phase 1
0.75 Intermediate Similarity NPD4697 Phase 3
0.75 Intermediate Similarity NPD7513 Clinical (unspecified phase)
0.7473 Intermediate Similarity NPD6098 Approved
0.7447 Intermediate Similarity NPD7515 Phase 2
0.7447 Intermediate Similarity NPD5693 Phase 1
0.7447 Intermediate Similarity NPD6079 Approved
0.7423 Intermediate Similarity NPD7902 Approved
0.7416 Intermediate Similarity NPD3667 Approved
0.7386 Intermediate Similarity NPD4695 Discontinued
0.7379 Intermediate Similarity NPD6373 Approved
0.7379 Intermediate Similarity NPD6372 Approved
0.734 Intermediate Similarity NPD4096 Approved
0.7317 Intermediate Similarity NPD3621 Clinical (unspecified phase)
0.7303 Intermediate Similarity NPD4692 Approved
0.7303 Intermediate Similarity NPD4139 Approved
0.73 Intermediate Similarity NPD5091 Approved
0.7292 Intermediate Similarity NPD6001 Approved
0.7292 Intermediate Similarity NPD7748 Approved
0.7273 Intermediate Similarity NPD6404 Discontinued
0.7273 Intermediate Similarity NPD4195 Approved
0.7262 Intermediate Similarity NPD6081 Approved
0.7255 Intermediate Similarity NPD7128 Approved
0.7255 Intermediate Similarity NPD6675 Approved
0.7255 Intermediate Similarity NPD6402 Approved
0.7255 Intermediate Similarity NPD5739 Approved
0.7238 Intermediate Similarity NPD6650 Approved
0.7238 Intermediate Similarity NPD6649 Approved
0.7216 Intermediate Similarity NPD5654 Approved
0.7188 Intermediate Similarity NPD5133 Approved
0.7188 Intermediate Similarity NPD4202 Approved
0.7184 Intermediate Similarity NPD6614 Approved
0.7159 Intermediate Similarity NPD5784 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD5222 Approved
0.7143 Intermediate Similarity NPD5221 Approved
0.7143 Intermediate Similarity NPD5220 Clinical (unspecified phase)
0.7128 Intermediate Similarity NPD4518 Approved
0.7115 Intermediate Similarity NPD7320 Approved
0.7115 Intermediate Similarity NPD6899 Approved
0.7115 Intermediate Similarity NPD6881 Approved
0.7113 Intermediate Similarity NPD7901 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD7900 Approved
0.7097 Intermediate Similarity NPD4623 Approved
0.7097 Intermediate Similarity NPD4519 Discontinued
0.7083 Intermediate Similarity NPD8034 Phase 2
0.7083 Intermediate Similarity NPD8035 Phase 2
0.7071 Intermediate Similarity NPD4755 Approved
0.7071 Intermediate Similarity NPD5173 Approved
0.7071 Intermediate Similarity NPD5959 Approved
0.7065 Intermediate Similarity NPD3668 Phase 3
0.7059 Intermediate Similarity NPD6052 Approved
0.7019 Intermediate Similarity NPD5701 Approved
0.7019 Intermediate Similarity NPD5697 Approved
0.6989 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6981 Remote Similarity NPD7290 Approved
0.6981 Remote Similarity NPD6883 Approved
0.6981 Remote Similarity NPD7102 Approved
0.697 Remote Similarity NPD7732 Phase 3
0.6957 Remote Similarity NPD4788 Approved
0.6957 Remote Similarity NPD3527 Clinical (unspecified phase)
0.6952 Remote Similarity NPD6011 Approved
0.6931 Remote Similarity NPD5286 Approved
0.6931 Remote Similarity NPD4700 Approved
0.6931 Remote Similarity NPD4696 Approved
0.6931 Remote Similarity NPD5285 Approved
0.6916 Remote Similarity NPD8130 Phase 1
0.6916 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6916 Remote Similarity NPD6617 Approved
0.6916 Remote Similarity NPD6869 Approved
0.6916 Remote Similarity NPD6847 Approved
0.6887 Remote Similarity NPD6012 Approved
0.6887 Remote Similarity NPD6014 Approved
0.6887 Remote Similarity NPD6013 Approved
0.6863 Remote Similarity NPD5223 Approved
0.686 Remote Similarity NPD4243 Approved
0.6852 Remote Similarity NPD6882 Approved
0.6852 Remote Similarity NPD8297 Approved
0.6842 Remote Similarity NPD3573 Approved
0.6832 Remote Similarity NPD7638 Approved
0.6796 Remote Similarity NPD5226 Approved
0.6796 Remote Similarity NPD5211 Phase 2
0.6796 Remote Similarity NPD4633 Approved
0.6796 Remote Similarity NPD5224 Approved
0.6796 Remote Similarity NPD5225 Approved
0.6765 Remote Similarity NPD7640 Approved
0.6765 Remote Similarity NPD7639 Approved
0.6762 Remote Similarity NPD6008 Approved
0.6757 Remote Similarity NPD7115 Discovery
0.6731 Remote Similarity NPD5175 Approved
0.6731 Remote Similarity NPD5174 Approved
0.6731 Remote Similarity NPD4754 Approved
0.6705 Remote Similarity NPD4784 Approved
0.6705 Remote Similarity NPD4785 Approved
0.6698 Remote Similarity NPD6412 Phase 2
0.6667 Remote Similarity NPD4752 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6868 Approved
0.6667 Remote Similarity NPD5141 Approved
0.6667 Remote Similarity NPD7331 Phase 2
0.6667 Remote Similarity NPD4224 Phase 2
0.6636 Remote Similarity NPD4632 Approved
0.6633 Remote Similarity NPD5785 Approved
0.6632 Remote Similarity NPD5363 Approved
0.663 Remote Similarity NPD8259 Clinical (unspecified phase)
0.6629 Remote Similarity NPD6942 Approved
0.6629 Remote Similarity NPD7339 Approved
0.6604 Remote Similarity NPD4768 Approved
0.6604 Remote Similarity NPD4767 Approved
0.6566 Remote Similarity NPD6411 Approved
0.6559 Remote Similarity NPD8028 Phase 2
0.6559 Remote Similarity NPD5369 Approved
0.6549 Remote Similarity NPD6335 Approved
0.6518 Remote Similarity NPD6274 Approved
0.6491 Remote Similarity NPD7101 Approved
0.6491 Remote Similarity NPD7100 Approved
0.6489 Remote Similarity NPD4270 Approved
0.6489 Remote Similarity NPD4269 Approved
0.6481 Remote Similarity NPD5128 Approved
0.6481 Remote Similarity NPD5168 Approved
0.6481 Remote Similarity NPD4730 Approved
0.6481 Remote Similarity NPD4729 Approved
0.646 Remote Similarity NPD6317 Approved
0.646 Remote Similarity NPD6009 Approved
0.6458 Remote Similarity NPD1694 Approved
0.6452 Remote Similarity NPD4252 Approved
0.6452 Remote Similarity NPD5368 Approved
0.6452 Remote Similarity NPD7525 Registered
0.6444 Remote Similarity NPD5275 Approved
0.6444 Remote Similarity NPD4190 Phase 3
0.6421 Remote Similarity NPD5362 Discontinued
0.642 Remote Similarity NPD287 Approved
0.6404 Remote Similarity NPD6314 Approved
0.6404 Remote Similarity NPD6313 Approved
0.64 Remote Similarity NPD7637 Suspended
0.6392 Remote Similarity NPD5786 Approved
0.6379 Remote Similarity NPD6908 Approved
0.6379 Remote Similarity NPD6291 Clinical (unspecified phase)
0.6379 Remote Similarity NPD6909 Approved
0.6374 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6374 Remote Similarity NPD6117 Approved
0.6364 Remote Similarity NPD6101 Approved
0.6364 Remote Similarity NPD5247 Approved
0.6364 Remote Similarity NPD5248 Approved

Structure

External Identifiers

PubChem CID   14193983
ChEMBL   CHEMBL2203604
ZINC  

Physicochemical Properties

Molecular Weight:  510.26
ALogP:  1.3255
MLogP:  3.99
XLogP:  0.758
# Rotatable Bonds:  13
Polar Surface Area:  122.65
# H-Bond Aceptor:  7
# H-Bond Donor:  1
# Rings:  4
# Heavy Atoms:  37

Download Data

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Structure MOL file  
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Biological Activities  
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