Natural Product: NPC174765

Natural Product ID:  NPC174765
Common Name:   Methoxy Clavigerin C
IUPAC Name:  
Synonyms:   Methoxy Clavigerin C
Molecular Formula:   C16H24O3
Standard InCHIKey:  MCUOTNFFHWLCLN-LEOABGAYSA-N
Standard InCHI:  InChI=1S/C16H24O3/c1-9(2)5-11(17)8-16-12-7-13(16)14(6-10(12)3)19-15(16)18-4/h6,9,12-15H,5,7-8H2,1-4H3/t12-,13+,14-,15+,16+/m1/s1
Canonical SMILES:  CO[C@H]1O[C@H]2[C@H]3[C@]1(CC(=O)CC(C)C)[C@H](C3)C(=C2)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
NPO25378 Lepidolaena clavigera Species Lepidolaenaceae Eukaryota PMID[18232639]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Activity = -12 % 17844994
NPT2 Others Unspecified Survival = 86 % 17844994

  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 NPC174765 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
0.9651 High Similarity NPC471571
0.9432 High Similarity NPC473369
0.8925 High Similarity NPC473384
0.8261 Intermediate Similarity NPC65513
0.8211 Intermediate Similarity NPC76266
0.8202 Intermediate Similarity NPC300985
0.8163 Intermediate Similarity NPC471364
0.8163 Intermediate Similarity NPC132395
0.8163 Intermediate Similarity NPC471365
0.8105 Intermediate Similarity NPC112654
0.7978 Intermediate Similarity NPC193198
0.7935 Intermediate Similarity NPC477128
0.7917 Intermediate Similarity NPC311166
0.7889 Intermediate Similarity NPC469569
0.7841 Intermediate Similarity NPC195424
0.7835 Intermediate Similarity NPC204054
0.7835 Intermediate Similarity NPC257726
0.7802 Intermediate Similarity NPC110405
0.7789 Intermediate Similarity NPC166346
0.7767 Intermediate Similarity NPC112457
0.7766 Intermediate Similarity NPC327183
0.7766 Intermediate Similarity NPC328935
0.7766 Intermediate Similarity NPC152467
0.7753 Intermediate Similarity NPC149237
0.7742 Intermediate Similarity NPC226863
0.7717 Intermediate Similarity NPC470050
0.7717 Intermediate Similarity NPC220478
0.7717 Intermediate Similarity NPC470051
0.7708 Intermediate Similarity NPC88507
0.7692 Intermediate Similarity NPC71626
0.7684 Intermediate Similarity NPC141831
0.766 Intermediate Similarity NPC293044
0.7629 Intermediate Similarity NPC316215
0.7614 Intermediate Similarity NPC471220
0.7609 Intermediate Similarity NPC189311
0.7582 Intermediate Similarity NPC22611
0.7582 Intermediate Similarity NPC470046
0.7582 Intermediate Similarity NPC470047
0.7579 Intermediate Similarity NPC212679
0.7579 Intermediate Similarity NPC281942
0.7579 Intermediate Similarity NPC469595
0.7579 Intermediate Similarity NPC220454
0.7579 Intermediate Similarity NPC232426
0.7553 Intermediate Similarity NPC215831
0.7551 Intermediate Similarity NPC73858
0.7549 Intermediate Similarity NPC222161
0.7527 Intermediate Similarity NPC118266
0.7526 Intermediate Similarity NPC477129
0.7526 Intermediate Similarity NPC477130
0.7526 Intermediate Similarity NPC250075
0.7525 Intermediate Similarity NPC134077
0.75 Intermediate Similarity NPC473288
0.75 Intermediate Similarity NPC49420
0.75 Intermediate Similarity NPC165904
0.75 Intermediate Similarity NPC179517
0.7477 Intermediate Similarity NPC157441
0.7476 Intermediate Similarity NPC127790
0.7475 Intermediate Similarity NPC472188
0.7474 Intermediate Similarity NPC73995
0.7474 Intermediate Similarity NPC284561
0.7473 Intermediate Similarity NPC178676
0.7451 Intermediate Similarity NPC151516
0.7447 Intermediate Similarity NPC312561
0.7426 Intermediate Similarity NPC63249
0.7426 Intermediate Similarity NPC472643
0.7423 Intermediate Similarity NPC475657
0.7419 Intermediate Similarity NPC470048
0.7419 Intermediate Similarity NPC177932
0.7419 Intermediate Similarity NPC472442
0.7416 Intermediate Similarity NPC35574
0.74 Intermediate Similarity NPC318917
0.74 Intermediate Similarity NPC471366
0.74 Intermediate Similarity NPC176845
0.74 Intermediate Similarity NPC476800
0.74 Intermediate Similarity NPC472186
0.7396 Intermediate Similarity NPC469372
0.7391 Intermediate Similarity NPC472440
0.7383 Intermediate Similarity NPC12046
0.7383 Intermediate Similarity NPC194951
0.7368 Intermediate Similarity NPC196407
0.7363 Intermediate Similarity NPC475665
0.7347 Intermediate Similarity NPC474554
0.734 Intermediate Similarity NPC244174
0.7333 Intermediate Similarity NPC469690
0.7333 Intermediate Similarity NPC17550
0.7327 Intermediate Similarity NPC473204
0.7327 Intermediate Similarity NPC472187
0.7327 Intermediate Similarity NPC473545
0.7327 Intermediate Similarity NPC472644
0.732 Intermediate Similarity NPC284185
0.732 Intermediate Similarity NPC186363
0.732 Intermediate Similarity NPC233345
0.732 Intermediate Similarity NPC324157
0.732 Intermediate Similarity NPC190442
0.732 Intermediate Similarity NPC474631
0.7312 Intermediate Similarity NPC30486
0.7312 Intermediate Similarity NPC100391
0.7312 Intermediate Similarity NPC474359
0.7312 Intermediate Similarity NPC149869
0.7312 Intermediate Similarity NPC159635
0.7308 Intermediate Similarity NPC252296
0.7303 Intermediate Similarity NPC122264
0.7303 Intermediate Similarity NPC187568
0.7303 Intermediate Similarity NPC41780
0.73 Intermediate Similarity NPC69385
0.73 Intermediate Similarity NPC474343
0.73 Intermediate Similarity NPC38530
0.73 Intermediate Similarity NPC84335
0.73 Intermediate Similarity NPC476768
0.7292 Intermediate Similarity NPC251528
0.7292 Intermediate Similarity NPC470819
0.7292 Intermediate Similarity NPC5509
0.7283 Intermediate Similarity NPC186276
0.7283 Intermediate Similarity NPC109938
0.7283 Intermediate Similarity NPC122945
0.7282 Intermediate Similarity NPC475321
0.7282 Intermediate Similarity NPC254202
0.7273 Intermediate Similarity NPC471372
0.7273 Intermediate Similarity NPC472189
0.7273 Intermediate Similarity NPC471362
0.7263 Intermediate Similarity NPC38885
0.7263 Intermediate Similarity NPC74139
0.7255 Intermediate Similarity NPC474327
0.7245 Intermediate Similarity NPC229976
0.7245 Intermediate Similarity NPC476597
0.7245 Intermediate Similarity NPC277721
0.7245 Intermediate Similarity NPC267266
0.7245 Intermediate Similarity NPC476598
0.7238 Intermediate Similarity NPC184512
0.7234 Intermediate Similarity NPC119001
0.7234 Intermediate Similarity NPC52628
0.7234 Intermediate Similarity NPC470223
0.7234 Intermediate Similarity NPC161957
0.7234 Intermediate Similarity NPC147921
0.7228 Intermediate Similarity NPC23364
0.7228 Intermediate Similarity NPC222011
0.7228 Intermediate Similarity NPC473154
0.7222 Intermediate Similarity NPC222834
0.7216 Intermediate Similarity NPC470817
0.7216 Intermediate Similarity NPC8062
0.7216 Intermediate Similarity NPC477782
0.7216 Intermediate Similarity NPC471818
0.7216 Intermediate Similarity NPC253144
0.7212 Intermediate Similarity NPC119493
0.7212 Intermediate Similarity NPC474898
0.7204 Intermediate Similarity NPC222358
0.7204 Intermediate Similarity NPC469
0.7204 Intermediate Similarity NPC105173
0.72 Intermediate Similarity NPC94905
0.72 Intermediate Similarity NPC171598
0.72 Intermediate Similarity NPC8954
0.72 Intermediate Similarity NPC319692
0.72 Intermediate Similarity NPC17578
0.72 Intermediate Similarity NPC240673
0.72 Intermediate Similarity NPC325960
0.7196 Intermediate Similarity NPC83005
0.7191 Intermediate Similarity NPC226242
0.7191 Intermediate Similarity NPC41017
0.7188 Intermediate Similarity NPC474845
0.7188 Intermediate Similarity NPC24816
0.7188 Intermediate Similarity NPC28227
0.7184 Intermediate Similarity NPC238397
0.7184 Intermediate Similarity NPC471363
0.7174 Intermediate Similarity NPC281949
0.7174 Intermediate Similarity NPC38642
0.7174 Intermediate Similarity NPC301477
0.7174 Intermediate Similarity NPC25684
0.7174 Intermediate Similarity NPC282293
0.7172 Intermediate Similarity NPC470697
0.7172 Intermediate Similarity NPC148463
0.7172 Intermediate Similarity NPC476415
0.7172 Intermediate Similarity NPC476596
0.7172 Intermediate Similarity NPC53685
0.7172 Intermediate Similarity NPC475572
0.7158 Intermediate Similarity NPC250981
0.7158 Intermediate Similarity NPC6979
0.7158 Intermediate Similarity NPC474062
0.7158 Intermediate Similarity NPC173917
0.7157 Intermediate Similarity NPC473219
0.7157 Intermediate Similarity NPC476933
0.7157 Intermediate Similarity NPC469402
0.7157 Intermediate Similarity NPC476274
0.7157 Intermediate Similarity NPC470761
0.7143 Intermediate Similarity NPC472645
0.7143 Intermediate Similarity NPC469401
0.7143 Intermediate Similarity NPC70595
0.7143 Intermediate Similarity NPC74103
0.7143 Intermediate Similarity NPC469620
0.7143 Intermediate Similarity NPC127609
0.7143 Intermediate Similarity NPC123177
0.7143 Intermediate Similarity NPC469607
0.7143 Intermediate Similarity NPC477783
0.7143 Intermediate Similarity NPC150978
0.7143 Intermediate Similarity NPC233437
0.7143 Intermediate Similarity NPC207641
0.7129 Intermediate Similarity NPC10057
0.7129 Intermediate Similarity NPC98112
0.7129 Intermediate Similarity NPC187159
0.7129 Intermediate Similarity NPC285513
0.7129 Intermediate Similarity NPC254496

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC174765 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
0.7419 Intermediate Similarity NPD1694 Approved
0.7097 Intermediate Similarity NPD4752 Clinical (unspecified phase)
0.6979 Remote Similarity NPD7146 Approved
0.6979 Remote Similarity NPD6684 Approved
0.6979 Remote Similarity NPD5330 Approved
0.6979 Remote Similarity NPD6409 Approved
0.6979 Remote Similarity NPD7334 Approved
0.6979 Remote Similarity NPD7521 Approved
0.69 Remote Similarity NPD6399 Phase 3
0.6889 Remote Similarity NPD8039 Approved
0.6852 Remote Similarity NPD6686 Approved
0.6837 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6837 Remote Similarity NPD6903 Approved
0.6765 Remote Similarity NPD1698 Clinical (unspecified phase)
0.6759 Remote Similarity NPD6412 Phase 2
0.6737 Remote Similarity NPD3667 Approved
0.6667 Remote Similarity NPD6008 Approved
0.6667 Remote Similarity NPD7900 Approved
0.6667 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6667 Remote Similarity NPD5737 Approved
0.6667 Remote Similarity NPD6672 Approved
0.6634 Remote Similarity NPD5693 Phase 1
0.6633 Remote Similarity NPD3618 Phase 1
0.66 Remote Similarity NPD5328 Approved
0.6598 Remote Similarity NPD3665 Phase 1
0.6598 Remote Similarity NPD3133 Approved
0.6598 Remote Similarity NPD3668 Phase 3
0.6598 Remote Similarity NPD4786 Approved
0.6598 Remote Similarity NPD3666 Approved
0.6566 Remote Similarity NPD3573 Approved
0.6535 Remote Similarity NPD5207 Approved
0.6476 Remote Similarity NPD7902 Approved
0.6471 Remote Similarity NPD6079 Approved
0.6465 Remote Similarity NPD6098 Approved
0.646 Remote Similarity NPD6882 Approved
0.6442 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6436 Remote Similarity NPD6051 Approved
0.6387 Remote Similarity NPD6370 Approved
0.6381 Remote Similarity NPD4697 Phase 3
0.6364 Remote Similarity NPD1733 Clinical (unspecified phase)
0.6364 Remote Similarity NPD6675 Approved
0.6364 Remote Similarity NPD7507 Approved
0.6364 Remote Similarity NPD7128 Approved
0.6364 Remote Similarity NPD6402 Approved
0.6364 Remote Similarity NPD5739 Approved
0.6346 Remote Similarity NPD7748 Approved
0.6346 Remote Similarity NPD6001 Approved
0.6339 Remote Similarity NPD6373 Approved
0.6339 Remote Similarity NPD6372 Approved
0.6337 Remote Similarity NPD5208 Approved
0.6321 Remote Similarity NPD4755 Approved
0.6311 Remote Similarity NPD6411 Approved
0.6306 Remote Similarity NPD5701 Approved
0.6306 Remote Similarity NPD5697 Approved
0.6303 Remote Similarity NPD8517 Approved
0.6303 Remote Similarity NPD8513 Phase 3
0.6303 Remote Similarity NPD8515 Approved
0.6303 Remote Similarity NPD8516 Approved
0.63 Remote Similarity NPD5279 Phase 3
0.63 Remote Similarity NPD4623 Approved
0.63 Remote Similarity NPD4519 Discontinued
0.6286 Remote Similarity NPD5695 Phase 3
0.6275 Remote Similarity NPD1695 Approved
0.6275 Remote Similarity NPD6673 Approved
0.6275 Remote Similarity NPD6080 Approved
0.6275 Remote Similarity NPD6904 Approved
0.6263 Remote Similarity NPD6400 Clinical (unspecified phase)
0.6262 Remote Similarity NPD7638 Approved
0.6262 Remote Similarity NPD4225 Approved
0.6262 Remote Similarity NPD5696 Approved
0.625 Remote Similarity NPD6011 Approved
0.625 Remote Similarity NPD4202 Approved
0.625 Remote Similarity NPD6881 Approved
0.625 Remote Similarity NPD7320 Approved
0.625 Remote Similarity NPD6899 Approved
0.625 Remote Similarity NPD5779 Approved
0.625 Remote Similarity NPD5778 Approved
0.6239 Remote Similarity NPD5211 Phase 2
0.6228 Remote Similarity NPD6650 Approved
0.6228 Remote Similarity NPD6649 Approved
0.6226 Remote Similarity NPD5222 Approved
0.6226 Remote Similarity NPD5221 Approved
0.6226 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6224 Remote Similarity NPD4221 Approved
0.6224 Remote Similarity NPD4223 Phase 3
0.6224 Remote Similarity NPD6435 Approved
0.6224 Remote Similarity NPD5209 Approved
0.6218 Remote Similarity NPD6054 Approved
0.6218 Remote Similarity NPD6059 Approved
0.6214 Remote Similarity NPD5692 Phase 3
0.6214 Remote Similarity NPD5785 Approved
0.621 Remote Similarity NPD7319 Approved
0.6204 Remote Similarity NPD4700 Approved
0.6204 Remote Similarity NPD4696 Approved
0.6204 Remote Similarity NPD7640 Approved
0.6204 Remote Similarity NPD5286 Approved
0.6204 Remote Similarity NPD5285 Approved
0.6204 Remote Similarity NPD7639 Approved
0.6198 Remote Similarity NPD8328 Phase 3
0.6195 Remote Similarity NPD8132 Clinical (unspecified phase)
0.6195 Remote Similarity NPD6014 Approved
0.6195 Remote Similarity NPD6013 Approved
0.6195 Remote Similarity NPD6012 Approved
0.619 Remote Similarity NPD5282 Discontinued
0.6179 Remote Similarity NPD8293 Discontinued
0.6174 Remote Similarity NPD6053 Discontinued
0.6168 Remote Similarity NPD6084 Phase 2
0.6168 Remote Similarity NPD6083 Phase 2
0.6168 Remote Similarity NPD5173 Approved
0.6167 Remote Similarity NPD6015 Approved
0.6167 Remote Similarity NPD6016 Approved
0.6161 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6154 Remote Similarity NPD6050 Approved
0.6154 Remote Similarity NPD5284 Approved
0.6154 Remote Similarity NPD5281 Approved
0.6154 Remote Similarity NPD7515 Phase 2
0.6154 Remote Similarity NPD5694 Approved
0.6154 Remote Similarity NPD4137 Phase 3
0.6147 Remote Similarity NPD5223 Approved
0.6146 Remote Similarity NPD5784 Clinical (unspecified phase)
0.614 Remote Similarity NPD7102 Approved
0.614 Remote Similarity NPD6883 Approved
0.614 Remote Similarity NPD7290 Approved
0.6139 Remote Similarity NPD5786 Approved
0.6129 Remote Similarity NPD7736 Approved
0.6126 Remote Similarity NPD5141 Approved
0.6118 Remote Similarity NPD287 Approved
0.6117 Remote Similarity NPD5764 Clinical (unspecified phase)
0.6117 Remote Similarity NPD4753 Phase 2
0.6117 Remote Similarity NPD6101 Approved
0.6116 Remote Similarity NPD5988 Approved
0.6102 Remote Similarity NPD7115 Discovery
0.6102 Remote Similarity NPD6009 Approved
0.61 Remote Similarity NPD4197 Approved
0.6091 Remote Similarity NPD5226 Approved
0.6091 Remote Similarity NPD5225 Approved
0.6091 Remote Similarity NPD4633 Approved
0.6091 Remote Similarity NPD5224 Approved
0.6087 Remote Similarity NPD4691 Approved
0.6087 Remote Similarity NPD8130 Phase 1
0.6087 Remote Similarity NPD6617 Approved
0.6087 Remote Similarity NPD6847 Approved
0.6087 Remote Similarity NPD6869 Approved
0.6087 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6087 Remote Similarity NPD4747 Approved
0.6066 Remote Similarity NPD6067 Discontinued
0.6044 Remote Similarity NPD3621 Clinical (unspecified phase)
0.604 Remote Similarity NPD5329 Approved
0.604 Remote Similarity NPD6082 Clinical (unspecified phase)
0.6036 Remote Similarity NPD5175 Approved
0.6036 Remote Similarity NPD5174 Approved
0.6036 Remote Similarity NPD4754 Approved
0.6034 Remote Similarity NPD8297 Approved
0.6032 Remote Similarity NPD6914 Discontinued
0.602 Remote Similarity NPD5368 Approved
0.602 Remote Similarity NPD4695 Discontinued
0.6016 Remote Similarity NPD7492 Approved
0.6 Remote Similarity NPD7331 Phase 2
0.6 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6 Remote Similarity NPD8035 Phase 2
0.6 Remote Similarity NPD8034 Phase 2
0.5983 Remote Similarity NPD8133 Approved
0.5981 Remote Similarity NPD5210 Approved
0.5981 Remote Similarity NPD4629 Approved
0.598 Remote Similarity NPD4688 Approved
0.598 Remote Similarity NPD5280 Approved
0.598 Remote Similarity NPD5690 Phase 2
0.598 Remote Similarity NPD4690 Approved
0.598 Remote Similarity NPD3574 Clinical (unspecified phase)
0.598 Remote Similarity NPD4694 Approved
0.598 Remote Similarity NPD4138 Approved
0.598 Remote Similarity NPD4693 Phase 3
0.598 Remote Similarity NPD4689 Approved
0.598 Remote Similarity NPD5205 Approved
0.5979 Remote Similarity NPD3617 Approved
0.5968 Remote Similarity NPD6616 Approved
0.5966 Remote Similarity NPD8295 Clinical (unspecified phase)
0.5955 Remote Similarity NPD5325 Clinical (unspecified phase)
0.5948 Remote Similarity NPD8413 Clinical (unspecified phase)
0.5935 Remote Similarity NPD7122 Discontinued
0.5929 Remote Similarity NPD4768 Approved
0.5929 Remote Similarity NPD4767 Approved
0.5926 Remote Similarity NPD5349 Clinical (unspecified phase)
0.592 Remote Similarity NPD7078 Approved
0.5913 Remote Similarity NPD4061 Clinical (unspecified phase)
0.5905 Remote Similarity NPD46 Approved
0.5905 Remote Similarity NPD6698 Approved
0.5902 Remote Similarity NPD6291 Clinical (unspecified phase)
0.59 Remote Similarity NPD4269 Approved
0.59 Remote Similarity NPD4270 Approved
0.5895 Remote Similarity NPD4058 Approved
0.5895 Remote Similarity NPD5733 Approved
0.5895 Remote Similarity NPD4687 Approved
0.5893 Remote Similarity NPD6052 Approved
0.5889 Remote Similarity NPD2685 Clinical (unspecified phase)
0.5889 Remote Similarity NPD7341 Phase 2
0.5882 Remote Similarity NPD6274 Approved
0.5882 Remote Similarity NPD1696 Phase 3
0.5873 Remote Similarity NPD6033 Approved
0.5862 Remote Similarity NPD6371 Approved

Structure

External Identifiers

PubChem CID   24799156
ChEMBL   CHEMBL255494
ZINC  

Physicochemical Properties

Molecular Weight:  264.17
ALogP:  0.4244
MLogP:  2.89
XLogP:  2.096
# Rotatable Bonds:  9
Polar Surface Area:  35.53
# H-Bond Aceptor:  3
# H-Bond Donor:  0
# Rings:  2
# Heavy Atoms:  19

Download Data

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