Natural Product: NPC296367

Natural Product ID:  NPC296367
Common Name:   Poricoic Acid Cm
IUPAC Name:   2-[(3R,3aR,6S,7S,9bR)-6-(3-methoxy-3-oxopropyl)-3a,6,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-3-yl]-6-methyl-5-methylideneheptanoic acid
Synonyms:   poricoic acid CM
Molecular Formula:   C32H48O4
Standard InCHIKey:  BTOTUPNTIAMSIV-CCQCPENESA-N
Standard InCHI:  InChI=1S/C32H48O4/c1-20(2)22(5)10-11-23(29(34)35)25-14-18-32(8)27-13-12-24(21(3)4)30(6,17-16-28(33)36-9)26(27)15-19-31(25,32)7/h13,15,20,23-25H,3,5,10-12,14,16-19H2,1-2,4,6-9H3,(H,34,35)/t23?,24-,25+,30-,31+,32-/m0/s1
Canonical SMILES:  COC(=O)CC[C@@]1(C)[C@@H](CC=C2C1=CC[C@]1([C@@]2(C)CC[C@@H]1C(C(=O)O)CCC(=C)C(C)C)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
NPO33546 Poria coco Species Eukaryota Yunnan, Kunming, China PMID[17488130]
NPO23577 Wolfiporia cocos Species Coriolaceae Eukaryota TM-MC*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 0 % 17488130
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 37.2 % 17488130
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 63.4 % 17488130
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 87.6 % 17488130
NPT80 Cell Line Raji Homo sapiens Activity = 70 % 17488130

  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 NPC296367 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
0.9605 High Similarity NPC274996
0.9605 High Similarity NPC196827
0.9125 High Similarity NPC310470
0.9048 High Similarity NPC123854
0.8889 High Similarity NPC69279
0.8889 High Similarity NPC83569
0.881 High Similarity NPC247406
0.881 High Similarity NPC48866
0.8736 High Similarity NPC7165
0.8701 High Similarity NPC306928
0.8701 High Similarity NPC301065
0.8642 High Similarity NPC201912
0.8642 High Similarity NPC38350
0.8636 High Similarity NPC20546
0.8625 High Similarity NPC327674
0.8625 High Similarity NPC477371
0.8605 High Similarity NPC111585
0.8605 High Similarity NPC148414
0.8605 High Similarity NPC46281
0.8605 High Similarity NPC175628
0.8588 High Similarity NPC294480
0.8588 High Similarity NPC183546
0.8537 High Similarity NPC133391
0.8537 High Similarity NPC260956
0.8537 High Similarity NPC240302
0.8506 High Similarity NPC26888
0.8506 High Similarity NPC45269
0.85 High Similarity NPC321514
0.8488 Intermediate Similarity NPC474570
0.8488 Intermediate Similarity NPC474889
0.8488 Intermediate Similarity NPC77168
0.8488 Intermediate Similarity NPC102414
0.8488 Intermediate Similarity NPC84271
0.8481 Intermediate Similarity NPC309399
0.8481 Intermediate Similarity NPC899
0.8471 Intermediate Similarity NPC167877
0.8471 Intermediate Similarity NPC312215
0.8444 Intermediate Similarity NPC469432
0.8434 Intermediate Similarity NPC477373
0.8415 Intermediate Similarity NPC477372
0.8415 Intermediate Similarity NPC327002
0.8415 Intermediate Similarity NPC147066
0.8409 Intermediate Similarity NPC66429
0.8409 Intermediate Similarity NPC152897
0.8395 Intermediate Similarity NPC158846
0.8391 Intermediate Similarity NPC471896
0.8353 Intermediate Similarity NPC212843
0.8352 Intermediate Similarity NPC477813
0.8333 Intermediate Similarity NPC165064
0.8333 Intermediate Similarity NPC164577
0.8315 Intermediate Similarity NPC469406
0.8295 Intermediate Similarity NPC473986
0.8295 Intermediate Similarity NPC204341
0.8295 Intermediate Similarity NPC474018
0.8293 Intermediate Similarity NPC477057
0.8293 Intermediate Similarity NPC104545
0.8272 Intermediate Similarity NPC4827
0.8256 Intermediate Similarity NPC233836
0.8256 Intermediate Similarity NPC128644
0.8256 Intermediate Similarity NPC187376
0.8256 Intermediate Similarity NPC96496
0.8256 Intermediate Similarity NPC159046
0.8235 Intermediate Similarity NPC283733
0.8222 Intermediate Similarity NPC162001
0.8222 Intermediate Similarity NPC263347
0.8222 Intermediate Similarity NPC222845
0.8222 Intermediate Similarity NPC45324
0.8222 Intermediate Similarity NPC171395
0.8214 Intermediate Similarity NPC200752
0.8214 Intermediate Similarity NPC470015
0.8214 Intermediate Similarity NPC97913
0.8214 Intermediate Similarity NPC167103
0.8214 Intermediate Similarity NPC168188
0.8205 Intermediate Similarity NPC160817
0.8182 Intermediate Similarity NPC477147
0.8182 Intermediate Similarity NPC477149
0.8172 Intermediate Similarity NPC146822
0.8172 Intermediate Similarity NPC99411
0.8161 Intermediate Similarity NPC242864
0.8161 Intermediate Similarity NPC472220
0.8161 Intermediate Similarity NPC97884
0.814 Intermediate Similarity NPC28252
0.814 Intermediate Similarity NPC155011
0.814 Intermediate Similarity NPC55309
0.8132 Intermediate Similarity NPC155676
0.8125 Intermediate Similarity NPC476844
0.8118 Intermediate Similarity NPC472865
0.8118 Intermediate Similarity NPC100391
0.8118 Intermediate Similarity NPC194937
0.8118 Intermediate Similarity NPC476038
0.8095 Intermediate Similarity NPC320514
0.8095 Intermediate Similarity NPC321289
0.8095 Intermediate Similarity NPC15910
0.8095 Intermediate Similarity NPC327969
0.809 Intermediate Similarity NPC297265
0.809 Intermediate Similarity NPC470113
0.809 Intermediate Similarity NPC154101
0.8068 Intermediate Similarity NPC476733
0.8068 Intermediate Similarity NPC54689
0.8068 Intermediate Similarity NPC66344
0.8068 Intermediate Similarity NPC474704
0.8068 Intermediate Similarity NPC155479
0.8068 Intermediate Similarity NPC215029
0.8068 Intermediate Similarity NPC475921
0.8068 Intermediate Similarity NPC214387
0.8049 Intermediate Similarity NPC280654
0.8049 Intermediate Similarity NPC110094
0.8049 Intermediate Similarity NPC74410
0.8049 Intermediate Similarity NPC260385
0.8046 Intermediate Similarity NPC142361
0.8046 Intermediate Similarity NPC474684
0.8046 Intermediate Similarity NPC136948
0.8025 Intermediate Similarity NPC246445
0.8023 Intermediate Similarity NPC269638
0.8023 Intermediate Similarity NPC123319
0.8023 Intermediate Similarity NPC94531
0.8023 Intermediate Similarity NPC29447
0.8023 Intermediate Similarity NPC76333
0.8023 Intermediate Similarity NPC311702
0.8022 Intermediate Similarity NPC69548
0.8022 Intermediate Similarity NPC184848
0.8 Intermediate Similarity NPC3753
0.8 Intermediate Similarity NPC237591
0.8 Intermediate Similarity NPC55527
0.7978 Intermediate Similarity NPC469400
0.7976 Intermediate Similarity NPC142244
0.7957 Intermediate Similarity NPC186810
0.7957 Intermediate Similarity NPC166745
0.7957 Intermediate Similarity NPC48647
0.7957 Intermediate Similarity NPC235464
0.7955 Intermediate Similarity NPC44181
0.7955 Intermediate Similarity NPC472870
0.7955 Intermediate Similarity NPC24816
0.7952 Intermediate Similarity NPC199595
0.7935 Intermediate Similarity NPC42042
0.7935 Intermediate Similarity NPC120708
0.7931 Intermediate Similarity NPC186975
0.7931 Intermediate Similarity NPC89077
0.7931 Intermediate Similarity NPC264127
0.7927 Intermediate Similarity NPC471897
0.7927 Intermediate Similarity NPC107039
0.7927 Intermediate Similarity NPC238227
0.7927 Intermediate Similarity NPC471899
0.7912 Intermediate Similarity NPC49670
0.7912 Intermediate Similarity NPC159410
0.7907 Intermediate Similarity NPC473246
0.7907 Intermediate Similarity NPC19849
0.7907 Intermediate Similarity NPC472864
0.7907 Intermediate Similarity NPC320801
0.7901 Intermediate Similarity NPC192540
0.7901 Intermediate Similarity NPC279666
0.7889 Intermediate Similarity NPC23434
0.7889 Intermediate Similarity NPC476187
0.7889 Intermediate Similarity NPC189520
0.7872 Intermediate Similarity NPC241221
0.7865 Intermediate Similarity NPC262043
0.7857 Intermediate Similarity NPC37038
0.7849 Intermediate Similarity NPC202705
0.7841 Intermediate Similarity NPC136548
0.7841 Intermediate Similarity NPC236618
0.7831 Intermediate Similarity NPC179028
0.7831 Intermediate Similarity NPC321690
0.7826 Intermediate Similarity NPC293052
0.7826 Intermediate Similarity NPC317586
0.7826 Intermediate Similarity NPC469599
0.7826 Intermediate Similarity NPC279974
0.7826 Intermediate Similarity NPC470016
0.7816 Intermediate Similarity NPC470048
0.7816 Intermediate Similarity NPC474083
0.7816 Intermediate Similarity NPC473038
0.7816 Intermediate Similarity NPC11711
0.7816 Intermediate Similarity NPC470223
0.7805 Intermediate Similarity NPC69143
0.7805 Intermediate Similarity NPC89294
0.7805 Intermediate Similarity NPC180886
0.7802 Intermediate Similarity NPC470376
0.7802 Intermediate Similarity NPC170220
0.7802 Intermediate Similarity NPC107674
0.7802 Intermediate Similarity NPC472942
0.7802 Intermediate Similarity NPC470224
0.7802 Intermediate Similarity NPC243866
0.7802 Intermediate Similarity NPC470375
0.7802 Intermediate Similarity NPC141497
0.7802 Intermediate Similarity NPC263780
0.7802 Intermediate Similarity NPC206810
0.7791 Intermediate Similarity NPC271784
0.7791 Intermediate Similarity NPC477852
0.7791 Intermediate Similarity NPC70834
0.7778 Intermediate Similarity NPC129913
0.7778 Intermediate Similarity NPC103958
0.7778 Intermediate Similarity NPC166797
0.7778 Intermediate Similarity NPC183503
0.7778 Intermediate Similarity NPC161923
0.7778 Intermediate Similarity NPC251970
0.7778 Intermediate Similarity NPC283908
0.7778 Intermediate Similarity NPC476046
0.7778 Intermediate Similarity NPC241854
0.7778 Intermediate Similarity NPC69622
0.7778 Intermediate Similarity NPC213223
0.7766 Intermediate Similarity NPC471717

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC296367 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
0.809 Intermediate Similarity NPD5284 Approved
0.809 Intermediate Similarity NPD5281 Approved
0.8 Intermediate Similarity NPD6399 Phase 3
0.7889 Intermediate Similarity NPD6050 Approved
0.7826 Intermediate Similarity NPD5695 Phase 3
0.7778 Intermediate Similarity NPD5692 Phase 3
0.7753 Intermediate Similarity NPD6672 Approved
0.7753 Intermediate Similarity NPD5737 Approved
0.7727 Intermediate Similarity NPD5280 Approved
0.7727 Intermediate Similarity NPD5279 Phase 3
0.7727 Intermediate Similarity NPD4694 Approved
0.7701 Intermediate Similarity NPD4786 Approved
0.7692 Intermediate Similarity NPD5694 Approved
0.766 Intermediate Similarity NPD6084 Phase 2
0.766 Intermediate Similarity NPD6083 Phase 2
0.7582 Intermediate Similarity NPD5207 Approved
0.7528 Intermediate Similarity NPD6684 Approved
0.7528 Intermediate Similarity NPD7334 Approved
0.7528 Intermediate Similarity NPD5330 Approved
0.7528 Intermediate Similarity NPD7521 Approved
0.7528 Intermediate Similarity NPD6098 Approved
0.7528 Intermediate Similarity NPD6409 Approved
0.7528 Intermediate Similarity NPD7146 Approved
0.75 Intermediate Similarity NPD6411 Approved
0.75 Intermediate Similarity NPD6404 Discontinued
0.7473 Intermediate Similarity NPD6080 Approved
0.7473 Intermediate Similarity NPD7285 Clinical (unspecified phase)
0.7473 Intermediate Similarity NPD6673 Approved
0.7473 Intermediate Similarity NPD6904 Approved
0.7471 Intermediate Similarity NPD4221 Approved
0.7471 Intermediate Similarity NPD3667 Approved
0.7471 Intermediate Similarity NPD4223 Phase 3
0.7416 Intermediate Similarity NPD5329 Approved
0.7412 Intermediate Similarity NPD5784 Clinical (unspecified phase)
0.7396 Intermediate Similarity NPD5696 Approved
0.7363 Intermediate Similarity NPD6903 Approved
0.7363 Intermediate Similarity NPD7513 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD5733 Approved
0.734 Intermediate Similarity NPD7748 Approved
0.7333 Intermediate Similarity NPD5690 Phase 2
0.7312 Intermediate Similarity NPD8034 Phase 2
0.7312 Intermediate Similarity NPD8035 Phase 2
0.7303 Intermediate Similarity NPD3133 Approved
0.7303 Intermediate Similarity NPD3666 Approved
0.7303 Intermediate Similarity NPD3665 Phase 1
0.7303 Intermediate Similarity NPD4197 Approved
0.7283 Intermediate Similarity NPD5328 Approved
0.7283 Intermediate Similarity NPD5764 Clinical (unspecified phase)
0.7283 Intermediate Similarity NPD4753 Phase 2
0.7283 Intermediate Similarity NPD6101 Approved
0.7263 Intermediate Similarity NPD5654 Approved
0.7263 Intermediate Similarity NPD6356 Clinical (unspecified phase)
0.7262 Intermediate Similarity NPD8039 Approved
0.7222 Intermediate Similarity NPD7520 Clinical (unspecified phase)
0.7204 Intermediate Similarity NPD4096 Approved
0.7191 Intermediate Similarity NPD5362 Discontinued
0.7174 Intermediate Similarity NPD5208 Approved
0.7174 Intermediate Similarity NPD4518 Approved
0.7159 Intermediate Similarity NPD4692 Approved
0.7159 Intermediate Similarity NPD4139 Approved
0.7143 Intermediate Similarity NPD3618 Phase 1
0.7143 Intermediate Similarity NPD4687 Approved
0.7143 Intermediate Similarity NPD4689 Approved
0.7143 Intermediate Similarity NPD4693 Phase 3
0.7143 Intermediate Similarity NPD5205 Approved
0.7143 Intermediate Similarity NPD4138 Approved
0.7143 Intermediate Similarity NPD4690 Approved
0.7143 Intermediate Similarity NPD4688 Approved
0.7129 Intermediate Similarity NPD5739 Approved
0.7129 Intermediate Similarity NPD6402 Approved
0.7129 Intermediate Similarity NPD6675 Approved
0.7129 Intermediate Similarity NPD7128 Approved
0.7128 Intermediate Similarity NPD6079 Approved
0.7128 Intermediate Similarity NPD5693 Phase 1
0.7128 Intermediate Similarity NPD7515 Phase 2
0.7113 Intermediate Similarity NPD7902 Approved
0.7113 Intermediate Similarity NPD5959 Approved
0.7111 Intermediate Similarity NPD3668 Phase 3
0.7108 Intermediate Similarity NPD5276 Approved
0.7079 Intermediate Similarity NPD4752 Clinical (unspecified phase)
0.7053 Intermediate Similarity NPD5779 Approved
0.7053 Intermediate Similarity NPD5133 Approved
0.7053 Intermediate Similarity NPD5778 Approved
0.7011 Intermediate Similarity NPD3617 Approved
0.699 Remote Similarity NPD6881 Approved
0.699 Remote Similarity NPD7320 Approved
0.699 Remote Similarity NPD6899 Approved
0.6966 Remote Similarity NPD5369 Approved
0.6957 Remote Similarity NPD3574 Clinical (unspecified phase)
0.6952 Remote Similarity NPD8130 Phase 1
0.6947 Remote Similarity NPD7637 Suspended
0.6941 Remote Similarity NPD6926 Approved
0.6941 Remote Similarity NPD6924 Approved
0.6923 Remote Similarity NPD6372 Approved
0.6923 Remote Similarity NPD6373 Approved
0.6907 Remote Similarity NPD5210 Approved
0.6907 Remote Similarity NPD4629 Approved
0.6905 Remote Similarity NPD4243 Approved
0.6893 Remote Similarity NPD5701 Approved
0.6893 Remote Similarity NPD5697 Approved
0.6889 Remote Similarity NPD6435 Approved
0.6887 Remote Similarity NPD8297 Approved
0.6875 Remote Similarity NPD4202 Approved
0.6869 Remote Similarity NPD7638 Approved
0.686 Remote Similarity NPD7339 Approved
0.686 Remote Similarity NPD6942 Approved
0.6857 Remote Similarity NPD6883 Approved
0.6857 Remote Similarity NPD7290 Approved
0.6857 Remote Similarity NPD7102 Approved
0.6854 Remote Similarity NPD5368 Approved
0.6854 Remote Similarity NPD4695 Discontinued
0.6837 Remote Similarity NPD5222 Approved
0.6837 Remote Similarity NPD4697 Phase 3
0.6837 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6837 Remote Similarity NPD5221 Approved
0.6827 Remote Similarity NPD6011 Approved
0.6813 Remote Similarity NPD4788 Approved
0.6804 Remote Similarity NPD6001 Approved
0.6804 Remote Similarity NPD7900 Approved
0.6804 Remote Similarity NPD7901 Clinical (unspecified phase)
0.68 Remote Similarity NPD7640 Approved
0.68 Remote Similarity NPD7639 Approved
0.6792 Remote Similarity NPD6847 Approved
0.6792 Remote Similarity NPD6617 Approved
0.6792 Remote Similarity NPD6650 Approved
0.6792 Remote Similarity NPD6869 Approved
0.6792 Remote Similarity NPD6649 Approved
0.6792 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6786 Remote Similarity NPD4747 Approved
0.6782 Remote Similarity NPD6933 Approved
0.6768 Remote Similarity NPD5173 Approved
0.6768 Remote Similarity NPD4755 Approved
0.6762 Remote Similarity NPD6013 Approved
0.6762 Remote Similarity NPD6014 Approved
0.6762 Remote Similarity NPD6012 Approved
0.6744 Remote Similarity NPD4058 Approved
0.6744 Remote Similarity NPD4784 Approved
0.6744 Remote Similarity NPD4785 Approved
0.6742 Remote Similarity NPD4195 Approved
0.6737 Remote Similarity NPD6051 Approved
0.6729 Remote Similarity NPD6882 Approved
0.6706 Remote Similarity NPD6081 Approved
0.6703 Remote Similarity NPD4269 Approved
0.6703 Remote Similarity NPD4270 Approved
0.6667 Remote Similarity NPD8259 Clinical (unspecified phase)
0.6667 Remote Similarity NPD7732 Phase 3
0.6667 Remote Similarity NPD7525 Registered
0.6667 Remote Similarity NPD6922 Approved
0.6667 Remote Similarity NPD7614 Phase 1
0.6667 Remote Similarity NPD4137 Phase 3
0.6667 Remote Similarity NPD5785 Approved
0.6667 Remote Similarity NPD6923 Approved
0.6634 Remote Similarity NPD4696 Approved
0.6634 Remote Similarity NPD5285 Approved
0.6634 Remote Similarity NPD5286 Approved
0.6634 Remote Similarity NPD4700 Approved
0.663 Remote Similarity NPD5331 Approved
0.663 Remote Similarity NPD6695 Phase 3
0.663 Remote Similarity NPD5332 Approved
0.663 Remote Similarity NPD7154 Phase 3
0.6602 Remote Similarity NPD6052 Approved
0.6596 Remote Similarity NPD4623 Approved
0.6596 Remote Similarity NPD5786 Approved
0.6596 Remote Similarity NPD4519 Discontinued
0.6593 Remote Similarity NPD4790 Discontinued
0.6593 Remote Similarity NPD857 Phase 3
0.6591 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6591 Remote Similarity NPD6117 Approved
0.6588 Remote Similarity NPD7143 Approved
0.6588 Remote Similarity NPD4691 Approved
0.6588 Remote Similarity NPD7144 Approved
0.6571 Remote Similarity NPD6412 Phase 2
0.6569 Remote Similarity NPD5223 Approved
0.6559 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6556 Remote Similarity NPD6929 Approved
0.6552 Remote Similarity NPD6113 Clinical (unspecified phase)
0.6548 Remote Similarity NPD3621 Clinical (unspecified phase)
0.6545 Remote Similarity NPD6868 Approved
0.6526 Remote Similarity NPD3573 Approved
0.6526 Remote Similarity NPD7750 Discontinued
0.6517 Remote Similarity NPD6116 Phase 1
0.6514 Remote Similarity NPD4632 Approved
0.6512 Remote Similarity NPD7150 Approved
0.6512 Remote Similarity NPD7151 Approved
0.6512 Remote Similarity NPD7152 Approved
0.6506 Remote Similarity NPD7331 Phase 2
0.6506 Remote Similarity NPD4224 Phase 2
0.6505 Remote Similarity NPD5226 Approved
0.6505 Remote Similarity NPD5225 Approved
0.6505 Remote Similarity NPD4633 Approved
0.6505 Remote Similarity NPD5224 Approved
0.6505 Remote Similarity NPD5211 Phase 2
0.6489 Remote Similarity NPD6082 Clinical (unspecified phase)
0.6489 Remote Similarity NPD1694 Approved
0.6489 Remote Similarity NPD5363 Approved
0.6486 Remote Similarity NPD7115 Discovery
0.6484 Remote Similarity NPD4821 Approved
0.6484 Remote Similarity NPD4252 Approved
0.6484 Remote Similarity NPD6931 Approved
0.6484 Remote Similarity NPD4822 Approved

Structure

External Identifiers

PubChem CID   16736060
ChEMBL   CHEMBL374393
ZINC  

Physicochemical Properties

Molecular Weight:  496.36
ALogP:  4.178
MLogP:  4.54
XLogP:  9.222
# Rotatable Bonds:  19
Polar Surface Area:  63.6
# H-Bond Aceptor:  4
# H-Bond Donor:  1
# Rings:  3
# Heavy Atoms:  36

Download Data

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