Natural Product: NPC305160

Natural Product ID:  NPC305160
Common Name:   Virescenoside Q
IUPAC Name:   (2R,3S,4S,5S,6R)-2-[[(1S,2S,4aR,4bS,7S,10aR)-7-ethenyl-2-hydroxy-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-1-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Synonyms:   virescenoside Q
Molecular Formula:   C26H42O7
Standard InCHIKey:  MNLKJAWNYVVDPI-BSMMYCGNSA-N
Standard InCHI:  InChI=1S/C26H42O7/c1-5-24(2)10-8-16-15(12-24)6-7-18-25(16,3)11-9-19(28)26(18,4)14-32-23-22(31)21(30)20(29)17(13-27)33-23/h5-6,16-23,27-31H,1,7-14H2,2-4H3/t16-,17+,18+,19-,20+,21-,22-,23+,24-,25+,26+/m0/s1
Canonical SMILES:  OC[C@H]1O[C@@H](OC[C@@]2(C)[C@@H](O)CC[C@]3([C@H]2CC=C2[C@@H]3CC[C@](C2)(C)C=C)C)[C@H]([C@H]([C@@H]1O)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
NPO32826 acremonium striatisporum Species NA Eukaryota PMID[12027733]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified IC50 = 20000 nM 10.1007/s00044-010-9399-x

  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 NPC305160 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
0.9551 High Similarity NPC72817
0.9551 High Similarity NPC477927
0.9451 High Similarity NPC240372
0.9158 High Similarity NPC473129
0.9158 High Similarity NPC99627
0.9149 High Similarity NPC263756
0.9149 High Similarity NPC117714
0.914 High Similarity NPC477928
0.914 High Similarity NPC234287
0.914 High Similarity NPC158088
0.914 High Similarity NPC280825
0.913 High Similarity NPC207617
0.913 High Similarity NPC90583
0.9121 High Similarity NPC211238
0.9101 High Similarity NPC473058
0.9062 High Similarity NPC109792
0.9062 High Similarity NPC57065
0.9062 High Similarity NPC54521
0.9053 High Similarity NPC213674
0.9053 High Similarity NPC76497
0.9053 High Similarity NPC256133
0.9053 High Similarity NPC30289
0.9043 High Similarity NPC64348
0.9043 High Similarity NPC473200
0.9043 High Similarity NPC7341
0.9032 High Similarity NPC473890
0.9032 High Similarity NPC243728
0.9011 High Similarity NPC474792
0.9011 High Similarity NPC67398
0.9011 High Similarity NPC91654
0.9 High Similarity NPC159876
0.8958 High Similarity NPC162354
0.8958 High Similarity NPC473123
0.8958 High Similarity NPC473124
0.8958 High Similarity NPC123796
0.8947 High Similarity NPC267510
0.8947 High Similarity NPC4831
0.8947 High Similarity NPC309425
0.8947 High Similarity NPC88000
0.8947 High Similarity NPC129372
0.8947 High Similarity NPC472023
0.8947 High Similarity NPC160734
0.8947 High Similarity NPC47566
0.8936 High Similarity NPC5358
0.8936 High Similarity NPC216260
0.8913 High Similarity NPC96736
0.8913 High Similarity NPC178949
0.8901 High Similarity NPC302584
0.8878 High Similarity NPC257964
0.8866 High Similarity NPC148603
0.8866 High Similarity NPC110656
0.8866 High Similarity NPC203354
0.8866 High Similarity NPC471434
0.8866 High Similarity NPC473127
0.8866 High Similarity NPC470885
0.8866 High Similarity NPC187400
0.8866 High Similarity NPC471435
0.8866 High Similarity NPC75608
0.8866 High Similarity NPC221562
0.8866 High Similarity NPC230948
0.8866 High Similarity NPC173583
0.8866 High Similarity NPC473734
0.8854 High Similarity NPC312553
0.8854 High Similarity NPC288694
0.8854 High Similarity NPC272015
0.8854 High Similarity NPC159036
0.8854 High Similarity NPC136816
0.8854 High Similarity NPC154452
0.8842 High Similarity NPC473790
0.8842 High Similarity NPC282669
0.8791 High Similarity NPC261990
0.8791 High Similarity NPC474249
0.8788 High Similarity NPC126147
0.8776 High Similarity NPC470767
0.8776 High Similarity NPC242748
0.8776 High Similarity NPC138057
0.8776 High Similarity NPC470763
0.8776 High Similarity NPC173859
0.8776 High Similarity NPC470512
0.8763 High Similarity NPC213190
0.8763 High Similarity NPC473198
0.8763 High Similarity NPC131479
0.8763 High Similarity NPC157659
0.8763 High Similarity NPC245280
0.8763 High Similarity NPC189852
0.8763 High Similarity NPC286969
0.8763 High Similarity NPC114874
0.8763 High Similarity NPC31907
0.8763 High Similarity NPC155010
0.8763 High Similarity NPC472252
0.8763 High Similarity NPC16520
0.8763 High Similarity NPC8039
0.8763 High Similarity NPC211879
0.8763 High Similarity NPC120123
0.8763 High Similarity NPC16573
0.8763 High Similarity NPC473020
0.875 High Similarity NPC470434
0.875 High Similarity NPC21064
0.875 High Similarity NPC166279
0.875 High Similarity NPC285231
0.875 High Similarity NPC21568
0.875 High Similarity NPC121072
0.8696 High Similarity NPC48463
0.8696 High Similarity NPC289361
0.8687 High Similarity NPC190395
0.8687 High Similarity NPC78034
0.8687 High Similarity NPC33053
0.8687 High Similarity NPC281939
0.8673 High Similarity NPC93352
0.8673 High Similarity NPC470768
0.8673 High Similarity NPC312774
0.8673 High Similarity NPC475365
0.8673 High Similarity NPC273879
0.8673 High Similarity NPC165033
0.866 High Similarity NPC470571
0.8646 High Similarity NPC324598
0.8646 High Similarity NPC469942
0.8632 High Similarity NPC125551
0.8632 High Similarity NPC309503
0.8632 High Similarity NPC239547
0.8632 High Similarity NPC155319
0.8632 High Similarity NPC96597
0.8632 High Similarity NPC91197
0.8617 High Similarity NPC230347
0.8617 High Similarity NPC286612
0.8617 High Similarity NPC275310
0.8614 High Similarity NPC170974
0.8614 High Similarity NPC191439
0.8614 High Similarity NPC103627
0.86 High Similarity NPC80210
0.86 High Similarity NPC38376
0.8586 High Similarity NPC208594
0.8586 High Similarity NPC152584
0.8586 High Similarity NPC69737
0.8586 High Similarity NPC127801
0.8586 High Similarity NPC473199
0.8586 High Similarity NPC472898
0.8586 High Similarity NPC472900
0.8586 High Similarity NPC473476
0.8586 High Similarity NPC269627
0.8586 High Similarity NPC309448
0.8586 High Similarity NPC160816
0.8586 High Similarity NPC208477
0.8586 High Similarity NPC473923
0.8586 High Similarity NPC194842
0.8586 High Similarity NPC26798
0.8586 High Similarity NPC472899
0.8571 High Similarity NPC475701
0.8556 High Similarity NPC470836
0.8529 High Similarity NPC65034
0.8529 High Similarity NPC208189
0.8526 High Similarity NPC472989
0.8515 High Similarity NPC167383
0.8515 High Similarity NPC157530
0.8515 High Similarity NPC250089
0.8515 High Similarity NPC221110
0.8515 High Similarity NPC180459
0.8515 High Similarity NPC137917
0.8515 High Similarity NPC28844
0.8515 High Similarity NPC57362
0.8515 High Similarity NPC195116
0.8515 High Similarity NPC204407
0.8515 High Similarity NPC14630
0.8515 High Similarity NPC237503
0.8515 High Similarity NPC285253
0.8515 High Similarity NPC302057
0.8515 High Similarity NPC306746
0.8515 High Similarity NPC473318
0.8515 High Similarity NPC473328
0.85 High Similarity NPC208650
0.85 High Similarity NPC473469
0.85 High Similarity NPC63368
0.85 High Similarity NPC181467
0.85 High Similarity NPC283849
0.85 High Similarity NPC226642
0.85 High Similarity NPC234160
0.85 High Similarity NPC14946
0.85 High Similarity NPC231340
0.8485 Intermediate Similarity NPC31430
0.8485 Intermediate Similarity NPC85593
0.8485 Intermediate Similarity NPC474464
0.8462 Intermediate Similarity NPC189777
0.8454 Intermediate Similarity NPC317019
0.8447 Intermediate Similarity NPC473567
0.8447 Intermediate Similarity NPC216595
0.8447 Intermediate Similarity NPC231797
0.8438 Intermediate Similarity NPC76486
0.8438 Intermediate Similarity NPC471770
0.8438 Intermediate Similarity NPC473555
0.8438 Intermediate Similarity NPC278939
0.8431 Intermediate Similarity NPC279554
0.8431 Intermediate Similarity NPC476881
0.8431 Intermediate Similarity NPC59804
0.8431 Intermediate Similarity NPC476886
0.8431 Intermediate Similarity NPC220984
0.8431 Intermediate Similarity NPC475296
0.8431 Intermediate Similarity NPC65155
0.8431 Intermediate Similarity NPC90856
0.8431 Intermediate Similarity NPC476887
0.8431 Intermediate Similarity NPC7870

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC305160 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
0.8137 Intermediate Similarity NPD6412 Phase 2
0.7981 Intermediate Similarity NPD8132 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD7645 Phase 2
0.7727 Intermediate Similarity NPD7328 Approved
0.7727 Intermediate Similarity NPD7327 Approved
0.7679 Intermediate Similarity NPD7503 Approved
0.7658 Intermediate Similarity NPD7516 Approved
0.7589 Intermediate Similarity NPD8294 Approved
0.7589 Intermediate Similarity NPD8377 Approved
0.7547 Intermediate Similarity NPD6686 Approved
0.7544 Intermediate Similarity NPD8328 Phase 3
0.7522 Intermediate Similarity NPD8033 Approved
0.7522 Intermediate Similarity NPD8378 Approved
0.7522 Intermediate Similarity NPD8335 Approved
0.7522 Intermediate Similarity NPD8296 Approved
0.7522 Intermediate Similarity NPD8380 Approved
0.7522 Intermediate Similarity NPD8379 Approved
0.7477 Intermediate Similarity NPD8295 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD7525 Registered
0.7304 Intermediate Similarity NPD6370 Approved
0.7265 Intermediate Similarity NPD7507 Approved
0.7207 Intermediate Similarity NPD8133 Approved
0.7143 Intermediate Similarity NPD7736 Approved
0.713 Intermediate Similarity NPD6054 Approved
0.7129 Intermediate Similarity NPD8171 Discontinued
0.7083 Intermediate Similarity NPD7319 Approved
0.6983 Remote Similarity NPD6059 Approved
0.697 Remote Similarity NPD7524 Approved
0.6957 Remote Similarity NPD7339 Approved
0.6957 Remote Similarity NPD6942 Approved
0.6952 Remote Similarity NPD7638 Approved
0.6949 Remote Similarity NPD6067 Discontinued
0.6923 Remote Similarity NPD6016 Approved
0.6923 Remote Similarity NPD6015 Approved
0.6917 Remote Similarity NPD8293 Discontinued
0.6893 Remote Similarity NPD7748 Approved
0.6891 Remote Similarity NPD7492 Approved
0.6887 Remote Similarity NPD7640 Approved
0.6887 Remote Similarity NPD7639 Approved
0.6882 Remote Similarity NPD3701 Clinical (unspecified phase)
0.687 Remote Similarity NPD6009 Approved
0.6864 Remote Similarity NPD5988 Approved
0.6863 Remote Similarity NPD7515 Phase 2
0.6857 Remote Similarity NPD7902 Approved
0.6848 Remote Similarity NPD1811 Approved
0.6848 Remote Similarity NPD1810 Approved
0.6837 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6833 Remote Similarity NPD6616 Approved
0.6814 Remote Similarity NPD6882 Approved
0.678 Remote Similarity NPD8517 Approved
0.678 Remote Similarity NPD8516 Approved
0.678 Remote Similarity NPD8513 Phase 3
0.678 Remote Similarity NPD8515 Approved
0.6777 Remote Similarity NPD7078 Approved
0.6774 Remote Similarity NPD8449 Approved
0.6771 Remote Similarity NPD6928 Phase 2
0.6765 Remote Similarity NPD3168 Discontinued
0.6757 Remote Similarity NPD5345 Clinical (unspecified phase)
0.6754 Remote Similarity NPD4632 Approved
0.6735 Remote Similarity NPD6695 Phase 3
0.672 Remote Similarity NPD8450 Suspended
0.6696 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6695 Remote Similarity NPD6319 Approved
0.6667 Remote Similarity NPD5344 Discontinued
0.6667 Remote Similarity NPD8297 Approved
0.6636 Remote Similarity NPD4225 Approved
0.6635 Remote Similarity NPD6399 Phase 3
0.6607 Remote Similarity NPD6899 Approved
0.6607 Remote Similarity NPD6881 Approved
0.6581 Remote Similarity NPD7115 Discovery
0.6577 Remote Similarity NPD5739 Approved
0.6577 Remote Similarity NPD7128 Approved
0.6577 Remote Similarity NPD6675 Approved
0.6577 Remote Similarity NPD6402 Approved
0.6571 Remote Similarity NPD7900 Approved
0.6571 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6538 Remote Similarity NPD6079 Approved
0.6538 Remote Similarity NPD6411 Approved
0.6535 Remote Similarity NPD3618 Phase 1
0.6526 Remote Similarity NPD6933 Approved
0.6522 Remote Similarity NPD2686 Approved
0.6522 Remote Similarity NPD2687 Approved
0.6522 Remote Similarity NPD2254 Approved
0.6518 Remote Similarity NPD5697 Approved
0.6505 Remote Similarity NPD5328 Approved
0.65 Remote Similarity NPD4786 Approved
0.6495 Remote Similarity NPD6929 Approved
0.6491 Remote Similarity NPD7102 Approved
0.6491 Remote Similarity NPD7290 Approved
0.6491 Remote Similarity NPD4634 Approved
0.6491 Remote Similarity NPD6883 Approved
0.6486 Remote Similarity NPD8170 Clinical (unspecified phase)
0.6471 Remote Similarity NPD4751 Clinical (unspecified phase)
0.6471 Remote Similarity NPD7750 Discontinued
0.6465 Remote Similarity NPD3667 Approved
0.646 Remote Similarity NPD7320 Approved
0.6458 Remote Similarity NPD6932 Approved
0.6452 Remote Similarity NPD6033 Approved
0.6435 Remote Similarity NPD6617 Approved
0.6435 Remote Similarity NPD8130 Phase 1
0.6435 Remote Similarity NPD6869 Approved
0.6435 Remote Similarity NPD6650 Approved
0.6435 Remote Similarity NPD6649 Approved
0.6435 Remote Similarity NPD6847 Approved
0.6429 Remote Similarity NPD6931 Approved
0.6429 Remote Similarity NPD6930 Phase 2
0.6422 Remote Similarity NPD5286 Approved
0.6422 Remote Similarity NPD5285 Approved
0.6422 Remote Similarity NPD4696 Approved
0.6421 Remote Similarity NPD8264 Approved
0.6404 Remote Similarity NPD6014 Approved
0.6404 Remote Similarity NPD6373 Approved
0.6404 Remote Similarity NPD6012 Approved
0.6404 Remote Similarity NPD6372 Approved
0.6404 Remote Similarity NPD6013 Approved
0.6393 Remote Similarity NPD7604 Phase 2
0.6392 Remote Similarity NPD7145 Approved
0.6389 Remote Similarity NPD4755 Approved
0.6381 Remote Similarity NPD8035 Phase 2
0.6381 Remote Similarity NPD8034 Phase 2
0.6372 Remote Similarity NPD5701 Approved
0.6364 Remote Similarity NPD5983 Phase 2
0.6348 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6346 Remote Similarity NPD5764 Clinical (unspecified phase)
0.6346 Remote Similarity NPD6101 Approved
0.6344 Remote Similarity NPD7532 Clinical (unspecified phase)
0.6321 Remote Similarity NPD4202 Approved
0.6316 Remote Similarity NPD6926 Approved
0.6316 Remote Similarity NPD6924 Approved
0.6316 Remote Similarity NPD4785 Approved
0.6316 Remote Similarity NPD6011 Approved
0.6316 Remote Similarity NPD4784 Approved
0.6311 Remote Similarity NPD3573 Approved
0.6306 Remote Similarity NPD5225 Approved
0.6306 Remote Similarity NPD5226 Approved
0.6306 Remote Similarity NPD4633 Approved
0.6306 Remote Similarity NPD5224 Approved
0.6306 Remote Similarity NPD7632 Discontinued
0.6306 Remote Similarity NPD5211 Phase 2
0.6296 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6296 Remote Similarity NPD5222 Approved
0.6296 Remote Similarity NPD5221 Approved
0.6293 Remote Similarity NPD8413 Clinical (unspecified phase)
0.629 Remote Similarity NPD6336 Discontinued
0.6289 Remote Similarity NPD6925 Approved
0.6289 Remote Similarity NPD5776 Phase 2
0.6283 Remote Similarity NPD5357 Phase 1
0.6277 Remote Similarity NPD7150 Approved
0.6277 Remote Similarity NPD4243 Approved
0.6277 Remote Similarity NPD7151 Approved
0.6277 Remote Similarity NPD7152 Approved
0.6275 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6273 Remote Similarity NPD6648 Approved
0.6273 Remote Similarity NPD4700 Approved
0.6263 Remote Similarity NPD7509 Discontinued
0.6263 Remote Similarity NPD7332 Phase 2
0.6263 Remote Similarity NPD7514 Phase 3
0.625 Remote Similarity NPD5175 Approved
0.625 Remote Similarity NPD5174 Approved
0.6239 Remote Similarity NPD5173 Approved
0.6239 Remote Similarity NPD6084 Phase 2
0.6239 Remote Similarity NPD6083 Phase 2
0.6238 Remote Similarity NPD3669 Approved
0.6238 Remote Similarity NPD3670 Clinical (unspecified phase)
0.6237 Remote Similarity NPD4267 Clinical (unspecified phase)
0.6226 Remote Similarity NPD7087 Discontinued
0.6226 Remote Similarity NPD7637 Suspended
0.6222 Remote Similarity NPD371 Approved
0.6216 Remote Similarity NPD4159 Approved
0.6216 Remote Similarity NPD5223 Approved
0.62 Remote Similarity NPD6902 Approved
0.6195 Remote Similarity NPD5141 Approved
0.6182 Remote Similarity NPD8029 Clinical (unspecified phase)
0.6179 Remote Similarity NPD5125 Phase 3
0.6179 Remote Similarity NPD5126 Approved
0.6176 Remote Similarity NPD3133 Approved
0.6176 Remote Similarity NPD3665 Phase 1
0.6176 Remote Similarity NPD6400 Clinical (unspecified phase)
0.6176 Remote Similarity NPD3666 Approved
0.617 Remote Similarity NPD7143 Approved
0.617 Remote Similarity NPD7144 Approved
0.6168 Remote Similarity NPD5779 Approved
0.6168 Remote Similarity NPD5778 Approved
0.6162 Remote Similarity NPD6683 Phase 2
0.6154 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6147 Remote Similarity NPD4697 Phase 3
0.614 Remote Similarity NPD6008 Approved
0.6132 Remote Similarity NPD46 Approved
0.6132 Remote Similarity NPD7838 Discovery
0.6132 Remote Similarity NPD6698 Approved
0.6131 Remote Similarity NPD7625 Phase 1
0.6117 Remote Similarity NPD6893 Approved
0.6111 Remote Similarity NPD8074 Phase 3
0.61 Remote Similarity NPD4748 Discontinued
0.6098 Remote Similarity NPD6921 Approved
0.6095 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6094 Remote Similarity NPD5956 Approved
0.6087 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6066 Remote Similarity NPD7100 Approved
0.6066 Remote Similarity NPD7101 Approved

Structure

External Identifiers

PubChem CID   21672036
ChEMBL   CHEMBL516996
ZINC  

Physicochemical Properties

Molecular Weight:  466.29
ALogP:  -0.5608
MLogP:  3.55
XLogP:  4.063
# Rotatable Bonds:  13
Polar Surface Area:  119.61
# H-Bond Aceptor:  7
# H-Bond Donor:  5
# Rings:  4
# Heavy Atoms:  33

Download Data

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