Natural Product: NPC473328

Natural Product ID:  NPC473328
Common Name:   Goyaglycoside C
IUPAC Name:  
Synonyms:   Goyaglycoside C
Molecular Formula:   C38H62O9
Standard InCHIKey:  JYKQEJLWLRMCRC-KXCQKKMCSA-N
Standard InCHI:  InChI=1S/C38H62O9/c1-22(11-10-16-33(2,3)44-9)23-14-17-36(7)25-15-18-38-26(37(25,32(43-8)47-38)20-19-35(23,36)6)12-13-27(34(38,4)5)46-31-30(42)29(41)28(40)24(21-39)45-31/h10,15-16,18,22-32,39-42H,11-14,17,19-21H2,1-9H3/b16-10+/t22-,23-,24-,25+,26+,27+,28-,29+,30-,31+,32?,35-,36+,37+,38-/m1/s1
Canonical SMILES:  COC1O[C@@]23[C@H]([C@]41CC[C@]1([C@@]([C@@H]4C=C2)(C)CC[C@@H]1[C@@H](C/C=C/C(OC)(C)C)C)C)CC[C@@H](C3(C)C)O[C@@H]1O[C@H](CO)[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
NPO8182 Momordica charantia Species Cucurbitaceae Eukaryota PMID[17685651]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Inhibition = 13.5 % 15217282
NPT2 Others Unspecified Inhibition = 33.7 % PubChem BioAssay data set
NPT2 Others Unspecified Inhibition = 100 % 25871261
NPT2 Others Unspecified Inhibition = 80 % 17665952
NPT80 Cell Line Raji Homo sapiens Activity = 70 % 22113113

  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 NPC473328 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
1.0 High Similarity NPC473318
1.0 High Similarity NPC28844
0.9901 High Similarity NPC170974
0.9901 High Similarity NPC65155
0.9901 High Similarity NPC103627
0.9901 High Similarity NPC191439
0.9709 High Similarity NPC231797
0.9612 High Similarity NPC208189
0.9612 High Similarity NPC65034
0.9417 High Similarity NPC250089
0.9417 High Similarity NPC14630
0.9417 High Similarity NPC157530
0.9412 High Similarity NPC33053
0.94 High Similarity NPC37207
0.9333 High Similarity NPC216595
0.9333 High Similarity NPC473567
0.9307 High Similarity NPC471886
0.9307 High Similarity NPC471888
0.9307 High Similarity NPC471887
0.9307 High Similarity NPC471885
0.9216 High Similarity NPC93352
0.9208 High Similarity NPC300399
0.9208 High Similarity NPC471482
0.9151 High Similarity NPC475354
0.9135 High Similarity NPC80210
0.9135 High Similarity NPC38376
0.9135 High Similarity NPC235824
0.9118 High Similarity NPC213190
0.9109 High Similarity NPC285231
0.9109 High Similarity NPC21568
0.9057 High Similarity NPC13190
0.9048 High Similarity NPC195116
0.9048 High Similarity NPC221110
0.9048 High Similarity NPC180459
0.9048 High Similarity NPC285253
0.9048 High Similarity NPC472901
0.9038 High Similarity NPC226642
0.9029 High Similarity NPC75608
0.9029 High Similarity NPC475365
0.8972 High Similarity NPC112274
0.8952 High Similarity NPC472897
0.8952 High Similarity NPC472896
0.8942 High Similarity NPC472899
0.8942 High Similarity NPC26798
0.8942 High Similarity NPC472900
0.8942 High Similarity NPC472898
0.8932 High Similarity NPC471450
0.8922 High Similarity NPC309425
0.8922 High Similarity NPC4831
0.8922 High Similarity NPC472023
0.8922 High Similarity NPC160734
0.8922 High Similarity NPC129372
0.8922 High Similarity NPC47566
0.8922 High Similarity NPC88000
0.8911 High Similarity NPC5358
0.8911 High Similarity NPC216260
0.8889 High Similarity NPC51154
0.8879 High Similarity NPC110494
0.8879 High Similarity NPC157474
0.8879 High Similarity NPC473021
0.8879 High Similarity NPC472987
0.8868 High Similarity NPC128133
0.8857 High Similarity NPC231340
0.885 High Similarity NPC41129
0.8846 High Similarity NPC470885
0.8846 High Similarity NPC187400
0.8846 High Similarity NPC221562
0.8835 High Similarity NPC471889
0.8835 High Similarity NPC136816
0.8824 High Similarity NPC473200
0.8824 High Similarity NPC7341
0.8818 High Similarity NPC476690
0.8818 High Similarity NPC100048
0.8818 High Similarity NPC20979
0.8807 High Similarity NPC11548
0.8796 High Similarity NPC476305
0.8796 High Similarity NPC473125
0.8785 High Similarity NPC472717
0.8774 High Similarity NPC476538
0.8774 High Similarity NPC476540
0.8774 High Similarity NPC476539
0.8774 High Similarity NPC220427
0.8774 High Similarity NPC476541
0.875 High Similarity NPC131479
0.875 High Similarity NPC120123
0.875 High Similarity NPC472252
0.875 High Similarity NPC114874
0.875 High Similarity NPC245280
0.875 High Similarity NPC189852
0.875 High Similarity NPC473123
0.875 High Similarity NPC155010
0.875 High Similarity NPC157659
0.875 High Similarity NPC211879
0.875 High Similarity NPC473020
0.875 High Similarity NPC31907
0.875 High Similarity NPC473198
0.875 High Similarity NPC286969
0.875 High Similarity NPC8039
0.875 High Similarity NPC16520
0.875 High Similarity NPC473124
0.8739 High Similarity NPC10366
0.8738 High Similarity NPC470434
0.8727 High Similarity NPC477030
0.8727 High Similarity NPC477029
0.8725 High Similarity NPC280825
0.8725 High Similarity NPC234287
0.8725 High Similarity NPC158088
0.8716 High Similarity NPC469348
0.8716 High Similarity NPC49413
0.8716 High Similarity NPC44298
0.8716 High Similarity NPC290608
0.8716 High Similarity NPC473128
0.8716 High Similarity NPC469347
0.8716 High Similarity NPC40133
0.8704 High Similarity NPC472715
0.8704 High Similarity NPC197231
0.8692 High Similarity NPC477026
0.8692 High Similarity NPC70204
0.8692 High Similarity NPC477027
0.8692 High Similarity NPC306131
0.8692 High Similarity NPC476835
0.8692 High Similarity NPC475670
0.8679 High Similarity NPC190395
0.8667 High Similarity NPC85593
0.8667 High Similarity NPC203354
0.8667 High Similarity NPC312774
0.8667 High Similarity NPC273879
0.8667 High Similarity NPC31430
0.8667 High Similarity NPC110656
0.8667 High Similarity NPC165033
0.8667 High Similarity NPC473127
0.8661 High Similarity NPC477071
0.8654 High Similarity NPC272015
0.8654 High Similarity NPC288694
0.8654 High Similarity NPC312553
0.8654 High Similarity NPC159036
0.8649 High Similarity NPC471354
0.8649 High Similarity NPC244402
0.8649 High Similarity NPC203862
0.8649 High Similarity NPC34390
0.8649 High Similarity NPC474418
0.8649 High Similarity NPC84987
0.8649 High Similarity NPC142066
0.8649 High Similarity NPC196429
0.8649 High Similarity NPC77319
0.8649 High Similarity NPC471353
0.8649 High Similarity NPC158344
0.8649 High Similarity NPC471351
0.8649 High Similarity NPC157376
0.8649 High Similarity NPC471355
0.8649 High Similarity NPC93883
0.8649 High Similarity NPC473852
0.8649 High Similarity NPC309034
0.8649 High Similarity NPC99728
0.8649 High Similarity NPC243196
0.8649 High Similarity NPC50305
0.8649 High Similarity NPC87250
0.8649 High Similarity NPC27507
0.8641 High Similarity NPC324598
0.8641 High Similarity NPC469942
0.8627 High Similarity NPC243728
0.8627 High Similarity NPC473890
0.8627 High Similarity NPC240372
0.8624 High Similarity NPC477050
0.8624 High Similarity NPC472716
0.8624 High Similarity NPC19888
0.8624 High Similarity NPC42171
0.8611 High Similarity NPC141433
0.8585 High Similarity NPC69737
0.8585 High Similarity NPC208594
0.8585 High Similarity NPC152584
0.8585 High Similarity NPC473199
0.8585 High Similarity NPC473476
0.8585 High Similarity NPC269627
0.8585 High Similarity NPC309448
0.8585 High Similarity NPC181845
0.8585 High Similarity NPC160816
0.8585 High Similarity NPC208477
0.8585 High Similarity NPC127801
0.8585 High Similarity NPC242748
0.8585 High Similarity NPC474015
0.8585 High Similarity NPC194842
0.8585 High Similarity NPC473923
0.8584 High Similarity NPC475556
0.8584 High Similarity NPC475629
0.8571 High Similarity NPC16573
0.8571 High Similarity NPC45475
0.8571 High Similarity NPC160888
0.8571 High Similarity NPC83287
0.8571 High Similarity NPC475403
0.8571 High Similarity NPC475701
0.8559 High Similarity NPC5311
0.8559 High Similarity NPC99620
0.8559 High Similarity NPC199428
0.8559 High Similarity NPC310341
0.8559 High Similarity NPC148965
0.8559 High Similarity NPC207637
0.8559 High Similarity NPC193382
0.8558 High Similarity NPC267510
0.8558 High Similarity NPC176406

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC473328 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
0.8571 High Similarity NPD7328 Approved
0.8571 High Similarity NPD7327 Approved
0.8509 High Similarity NPD8378 Approved
0.8509 High Similarity NPD8380 Approved
0.8509 High Similarity NPD8379 Approved
0.8509 High Similarity NPD8296 Approved
0.8509 High Similarity NPD8335 Approved
0.8496 Intermediate Similarity NPD7516 Approved
0.8421 Intermediate Similarity NPD8294 Approved
0.8421 Intermediate Similarity NPD8377 Approved
0.8348 Intermediate Similarity NPD8033 Approved
0.819 Intermediate Similarity NPD7503 Approved
0.7917 Intermediate Similarity NPD7507 Approved
0.7869 Intermediate Similarity NPD7319 Approved
0.7586 Intermediate Similarity NPD8133 Approved
0.7547 Intermediate Similarity NPD8171 Discontinued
0.7522 Intermediate Similarity NPD6412 Phase 2
0.7456 Intermediate Similarity NPD6686 Approved
0.7377 Intermediate Similarity NPD6370 Approved
0.736 Intermediate Similarity NPD7736 Approved
0.7241 Intermediate Similarity NPD8132 Clinical (unspecified phase)
0.7213 Intermediate Similarity NPD6054 Approved
0.7154 Intermediate Similarity NPD8516 Approved
0.7154 Intermediate Similarity NPD8517 Approved
0.7154 Intermediate Similarity NPD8515 Approved
0.7154 Intermediate Similarity NPD8513 Phase 3
0.7143 Intermediate Similarity NPD8293 Discontinued
0.7075 Intermediate Similarity NPD7524 Approved
0.7073 Intermediate Similarity NPD6059 Approved
0.7059 Intermediate Similarity NPD7525 Registered
0.7054 Intermediate Similarity NPD7638 Approved
0.7016 Intermediate Similarity NPD6016 Approved
0.7016 Intermediate Similarity NPD6015 Approved
0.7 Intermediate Similarity NPD8449 Approved
0.6991 Remote Similarity NPD7640 Approved
0.6991 Remote Similarity NPD7639 Approved
0.6984 Remote Similarity NPD7492 Approved
0.6967 Remote Similarity NPD7115 Discovery
0.696 Remote Similarity NPD5988 Approved
0.6952 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6947 Remote Similarity NPD8450 Suspended
0.6929 Remote Similarity NPD6616 Approved
0.6905 Remote Similarity NPD8328 Phase 3
0.6897 Remote Similarity NPD8170 Clinical (unspecified phase)
0.6893 Remote Similarity NPD6928 Phase 2
0.6875 Remote Similarity NPD7078 Approved
0.6857 Remote Similarity NPD6695 Phase 3
0.6829 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6807 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6777 Remote Similarity NPD8297 Approved
0.6777 Remote Similarity NPD6882 Approved
0.6772 Remote Similarity NPD6067 Discontinued
0.6759 Remote Similarity NPD7750 Discontinued
0.6723 Remote Similarity NPD5345 Clinical (unspecified phase)
0.6714 Remote Similarity NPD7625 Phase 1
0.6694 Remote Similarity NPD6009 Approved
0.6694 Remote Similarity NPD8413 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6319 Approved
0.6638 Remote Similarity NPD4159 Approved
0.6638 Remote Similarity NPD5344 Discontinued
0.6635 Remote Similarity NPD7645 Phase 2
0.6612 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6609 Remote Similarity NPD4225 Approved
0.6606 Remote Similarity NPD4751 Clinical (unspecified phase)
0.6585 Remote Similarity NPD4632 Approved
0.6571 Remote Similarity NPD6930 Phase 2
0.6571 Remote Similarity NPD7514 Phase 3
0.6571 Remote Similarity NPD6931 Approved
0.6569 Remote Similarity NPD6942 Approved
0.6569 Remote Similarity NPD7339 Approved
0.6565 Remote Similarity NPD6033 Approved
0.6489 Remote Similarity NPD8074 Phase 3
0.6486 Remote Similarity NPD6051 Approved
0.6476 Remote Similarity NPD6929 Approved
0.6446 Remote Similarity NPD7320 Approved
0.6446 Remote Similarity NPD6881 Approved
0.6446 Remote Similarity NPD6899 Approved
0.6442 Remote Similarity NPD6932 Approved
0.6441 Remote Similarity NPD7632 Discontinued
0.6423 Remote Similarity NPD6649 Approved
0.6423 Remote Similarity NPD8130 Phase 1
0.6423 Remote Similarity NPD6650 Approved
0.6417 Remote Similarity NPD5739 Approved
0.6417 Remote Similarity NPD6675 Approved
0.6417 Remote Similarity NPD6402 Approved
0.6417 Remote Similarity NPD7128 Approved
0.6415 Remote Similarity NPD7332 Phase 2
0.6393 Remote Similarity NPD6373 Approved
0.6393 Remote Similarity NPD6372 Approved
0.6381 Remote Similarity NPD7145 Approved
0.6372 Remote Similarity NPD7087 Discontinued
0.6372 Remote Similarity NPD7637 Suspended
0.6364 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6364 Remote Similarity NPD5697 Approved
0.6355 Remote Similarity NPD6902 Approved
0.6346 Remote Similarity NPD6933 Approved
0.6346 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6341 Remote Similarity NPD7290 Approved
0.6341 Remote Similarity NPD7102 Approved
0.6341 Remote Similarity NPD6883 Approved
0.6341 Remote Similarity NPD4634 Approved
0.6325 Remote Similarity NPD8029 Clinical (unspecified phase)
0.6316 Remote Similarity NPD6399 Phase 3
0.6303 Remote Similarity NPD5211 Phase 2
0.629 Remote Similarity NPD6847 Approved
0.629 Remote Similarity NPD6617 Approved
0.629 Remote Similarity NPD6869 Approved
0.6286 Remote Similarity NPD5776 Phase 2
0.6286 Remote Similarity NPD6925 Approved
0.6281 Remote Similarity NPD6008 Approved
0.6273 Remote Similarity NPD6893 Approved
0.6271 Remote Similarity NPD6648 Approved
0.6271 Remote Similarity NPD5286 Approved
0.6271 Remote Similarity NPD5285 Approved
0.6271 Remote Similarity NPD4696 Approved
0.626 Remote Similarity NPD7604 Phase 2
0.626 Remote Similarity NPD6012 Approved
0.626 Remote Similarity NPD6014 Approved
0.626 Remote Similarity NPD6013 Approved
0.624 Remote Similarity NPD6053 Discontinued
0.6239 Remote Similarity NPD4755 Approved
0.6238 Remote Similarity NPD4267 Clinical (unspecified phase)
0.6231 Remote Similarity NPD6921 Approved
0.6231 Remote Similarity NPD5983 Phase 2
0.623 Remote Similarity NPD5701 Approved
0.6228 Remote Similarity NPD8035 Phase 2
0.6228 Remote Similarity NPD8034 Phase 2
0.6228 Remote Similarity NPD6079 Approved
0.6222 Remote Similarity NPD5956 Approved
0.6207 Remote Similarity NPD7991 Discontinued
0.6198 Remote Similarity NPD5141 Approved
0.6195 Remote Similarity NPD5328 Approved
0.6183 Remote Similarity NPD5126 Approved
0.6183 Remote Similarity NPD5125 Phase 3
0.6182 Remote Similarity NPD4786 Approved
0.6179 Remote Similarity NPD6011 Approved
0.6174 Remote Similarity NPD4202 Approved
0.6168 Remote Similarity NPD6683 Phase 2
0.6167 Remote Similarity NPD5226 Approved
0.6167 Remote Similarity NPD4633 Approved
0.6167 Remote Similarity NPD5225 Approved
0.6167 Remote Similarity NPD5224 Approved
0.6165 Remote Similarity NPD6336 Discontinued
0.6154 Remote Similarity NPD6924 Approved
0.6154 Remote Similarity NPD6926 Approved
0.6154 Remote Similarity NPD4784 Approved
0.6154 Remote Similarity NPD7741 Discontinued
0.6154 Remote Similarity NPD1810 Approved
0.6154 Remote Similarity NPD4785 Approved
0.6154 Remote Similarity NPD1811 Approved
0.6148 Remote Similarity NPD6640 Phase 3
0.614 Remote Similarity NPD3168 Discontinued
0.614 Remote Similarity NPD7838 Discovery
0.6134 Remote Similarity NPD4700 Approved
0.6121 Remote Similarity NPD7748 Approved
0.6117 Remote Similarity NPD4243 Approved
0.6116 Remote Similarity NPD5174 Approved
0.6116 Remote Similarity NPD5175 Approved
0.6102 Remote Similarity NPD6084 Phase 2
0.6102 Remote Similarity NPD6083 Phase 2
0.6102 Remote Similarity NPD7902 Approved
0.6083 Remote Similarity NPD5223 Approved
0.6071 Remote Similarity NPD3618 Phase 1
0.6062 Remote Similarity NPD7799 Discontinued
0.6055 Remote Similarity NPD6898 Phase 1
0.6048 Remote Similarity NPD4729 Approved
0.6048 Remote Similarity NPD4730 Approved
0.6036 Remote Similarity NPD6400 Clinical (unspecified phase)
0.6032 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6017 Remote Similarity NPD5222 Approved
0.6017 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6017 Remote Similarity NPD5221 Approved
0.6016 Remote Similarity NPD4768 Approved
0.6016 Remote Similarity NPD4767 Approved
0.6 Remote Similarity NPD3667 Approved
0.6 Remote Similarity NPD6698 Approved
0.6 Remote Similarity NPD46 Approved
0.5982 Remote Similarity NPD7520 Clinical (unspecified phase)
0.5968 Remote Similarity NPD7899 Clinical (unspecified phase)
0.5966 Remote Similarity NPD5173 Approved
0.5963 Remote Similarity NPD4748 Discontinued
0.5963 Remote Similarity NPD7509 Discontinued
0.5962 Remote Similarity NPD7150 Approved
0.5962 Remote Similarity NPD7152 Approved
0.5962 Remote Similarity NPD7151 Approved
0.5954 Remote Similarity NPD7101 Approved
0.5954 Remote Similarity NPD7100 Approved
0.5952 Remote Similarity NPD5250 Approved
0.5952 Remote Similarity NPD5248 Approved
0.5952 Remote Similarity NPD5249 Phase 3
0.5952 Remote Similarity NPD5247 Approved
0.5952 Remote Similarity NPD5251 Approved
0.5948 Remote Similarity NPD7515 Phase 2
0.5943 Remote Similarity NPD8264 Approved
0.5932 Remote Similarity NPD6356 Clinical (unspecified phase)
0.5926 Remote Similarity NPD7322 Clinical (unspecified phase)
0.5913 Remote Similarity NPD4753 Phase 2
0.5899 Remote Similarity NPD8338 Approved
0.5882 Remote Similarity NPD4697 Phase 3
0.5878 Remote Similarity NPD6335 Approved

Structure

External Identifiers

PubChem CID   44445563
ChEMBL   CHEMBL400775
ZINC  

Physicochemical Properties

Molecular Weight:  662.44
ALogP:  0.4866
MLogP:  4.65
XLogP:  6.892
# Rotatable Bonds:  22
Polar Surface Area:  127.07
# H-Bond Aceptor:  9
# H-Bond Donor:  4
# Rings:  6
# Heavy Atoms:  47

Download Data

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