ID: 80410
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 80411
SMILES:CC1(C)C2CCC(C)(Oc3c(O)c(CC=C(C)C)c(O)c(CCCCC)c32)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.055
InChIKey:DTWSONYZIKSSHQ-UHFFFAOYSA-N
ID: 80412
SMILES:CC(C)CC(=O)C1=C(C)CCC2C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -11.979
InChIKey:JABSOYCDQZKMGC-UHFFFAOYSA-N
ID: 80413
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)C)CCC(C)(O2)C1)=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -11.457
InChIKey:MKSVIURDFXDTMH-UHFFFAOYSA-N
ID: 80414
SMILES:CC(C)C1CCC(C)(O)C2Oc3c(c(O)cc(CCCC)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.603
InChIKey:AMOFKBQZCZHKDX-UHFFFAOYSA-N
ID: 80415
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 80416
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1=CCC(O)(C)CC1CC=C(C)CCC(C(O)(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -15.746
InChIKey:ULKFYPUQXNENSW-UHFFFAOYSA-N
ID: 80417
SMILES:O(c1c(CCCC)cc2c(c1O)C1C(CCC(COC3C(O)C(O)C(O)C(CO)O3)(C)O1)C(C)(C)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.623
CB1 binding score: -14.094
InChIKey:GNYWUCMWZBRNGE-UHFFFAOYSA-N
ID: 80418
SMILES:CCCCCc1cc2c(c3c1CC1C(C)COC1(C)O3)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.107
InChIKey:CEJUSFVKNGUHIY-UHFFFAOYSA-N
ID: 80419
SMILES:C(C)(C1C(=O)CC23OC2C(OC3=O)CC2(C)OC2c2c(O)cc(CCCC)cc21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -13.93
InChIKey:KAFXETWVYFRAPW-UHFFFAOYSA-N
ID: 80420
SMILES:c12c(O)cc(C)c(CCCCC)c1CC1(O)C=CC(C(CCC=C(C)C)(O)C)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.547
InChIKey:MWRLUGYCJBRJQH-UHFFFAOYSA-N
ID: 80421
SMILES:CC(=CCc1c(OC)cc(CCCCC)c(C(=O)O)c1O)CCC=C(C(=O)O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -15.967
InChIKey:BZUSDFQQQUIUQV-UHFFFAOYSA-N
ID: 80422
SMILES:Cc1cc(O)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.76
InChIKey:QSENNOHYZPYNTR-UHFFFAOYSA-N
ID: 80423
SMILES:C(C)CCc1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.334
InChIKey:MNUBYOPTBHHAIM-UHFFFAOYSA-N
ID: 80424
SMILES:O(C)C(C(Oc1c2c(c(C(=O)C(C)CC)cc1)OC(C)(C)C1C2C=C(C)CC1)=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.815
InChIKey:DLHPRTQDSQTGAZ-UHFFFAOYSA-N
ID: 80425
SMILES:c12c(cc(CCCCC)cc1OC)OC(C)(C)C(=O)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.117
InChIKey:AVZPJOSQJRPIRP-UHFFFAOYSA-N
ID: 80426
SMILES:OC12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.007
InChIKey:FXSXHYVMKQBBKA-UHFFFAOYSA-N
ID: 80427
SMILES:c1(O)cc(CCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 80428
SMILES:c1(O)cccc(CCCC)c1c1c(O)cc(CCCCC)c2c1OC(C)(C)C1C2C=C(C(=O)OC)C(OC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.719
CB1 binding score: -15.959
InChIKey:BVZZHIDBXGFPRJ-UHFFFAOYSA-N
ID: 80429
SMILES:C(CCCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1CC=C(C)C)c1ccc(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -14.965
InChIKey:RITXDFUAOHXBOP-UHFFFAOYSA-N
ID: 80430
SMILES:C1=C(C(=O)C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.441
InChIKey:HFFVREWQIRYFND-UHFFFAOYSA-N