ID: 66676
SMILES:CC1=CC2C(C(C)(C)Oc3c(O)c(C(O)C=C)cc(OC)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -10.904
InChIKey:BXEZVXXJVYNMMX-UHFFFAOYSA-N
ID: 66677
SMILES:C1C=C(C(=O)O)C2C3C1c1c(cc(CCCCC)cc1O)OC(C)(C)C3CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.609
InChIKey:UTEWNBGZNUYWBD-UHFFFAOYSA-N
ID: 66678
SMILES:Oc1cc2c(cc1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.725
InChIKey:DFKRODPVBXERME-UHFFFAOYSA-N
ID: 66679
SMILES:C1(C)(C)Oc2c(c(O)cc(CCc3ccccc3)c2)C2CC(C)=CCC12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 66680
SMILES:C(CCc1cc2c3c(c1C=O)OC1(C)CC3C(CC1)C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.506
InChIKey:LBPCCUDCEMKYQY-UHFFFAOYSA-N
ID: 66681
SMILES:CC(C)C1C(c2c(O)cc(CCCCC)cc2O)cc(O)c(O)c1CC=C(C)COC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.801
InChIKey:RVDFKKDYADQTEL-UHFFFAOYSA-N
ID: 66682
SMILES:C(CC)CCc1cc2c(c(O)c1)C1=C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 66683
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)OC(C)(C)C1CC=C(C=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.034
InChIKey:VIPKLEXAVIVDLJ-UHFFFAOYSA-N
ID: 66684
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3O)C3OC(C)(C)C4C3C1C(=C)CCC(=C2)C(C)(C)CC4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -12.539
InChIKey:CMURSNWNYZDOOT-UHFFFAOYSA-N
ID: 66685
SMILES:C(=CCC(C)CC(c1c(O)cc(CCCCC)cc1O)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.139
InChIKey:IKGJQBMUNRDUFM-UHFFFAOYSA-N
ID: 66686
SMILES:CC(C)C1=CCC(C)=CC1c1c(CCCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -15.239
InChIKey:DHTOGYWEVKHCJA-UHFFFAOYSA-N
ID: 66687
SMILES:c12c(O)cccc1OC(C)(C)C1C2C=C(C(OC)=O)CCC=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.325
InChIKey:GDEOJBCGOXOLJF-UHFFFAOYSA-N
ID: 66688
SMILES:c1(C(OC)=O)c(O)cc(CCCC)c(O)c1C1C(C(C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.435
InChIKey:BBYQIHLDTYZFAZ-UHFFFAOYSA-N
ID: 66689
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)(OC)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.884
InChIKey:IFYVJGYCDNFLKP-UHFFFAOYSA-N
ID: 66690
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N
ID: 66691
SMILES:C(CCC=C(C#CC=C(C)C)C)(C)=CCc1c(O)c(C)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -17.639
InChIKey:NFVPJEXAKNHWTP-UHFFFAOYSA-N
ID: 66692
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 66693
SMILES:C=C(C(O)Cc1c(O)c2c(c(C(=O)C(CC)C)c1O)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.26
InChIKey:RPWBUYNDFVCZMM-UHFFFAOYSA-N
ID: 66694
SMILES:COC(C1C2CC(C)(C)C2C(O)c2c(CCCCC)cc(O)cc2O1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -17.338
InChIKey:HRICQKUKDUKGES-UHFFFAOYSA-N
ID: 66695
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC1(C)C(CCC(C)=CCC(C(C)=C)C3CCC(=C)C3CC1CC=C(C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 558.847
CB1 binding score: -14.411
InChIKey:XJCVAFODZUORHD-UHFFFAOYSA-N
ID: 66696
SMILES:CC(CCC(=O)c1c2c(cc(O)c1O)C(=O)OC(C)(C)C1C2C(C)=CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.039
InChIKey:ILJLPZOZBZPHEB-UHFFFAOYSA-N