ID: 67537
SMILES:C1CC2C(C(C=C1)C1C=C(C)CCC1C(C)(O)CO)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.217
InChIKey:DFLNHINVVWRNDL-UHFFFAOYSA-N
ID: 67538
SMILES:C12C(C(C)(C)CCCC1O)Oc1cc(CCCCC)cc(O)c1C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.306
InChIKey:WGPCGPZMIGAPHG-UHFFFAOYSA-N
ID: 67539
SMILES:c12c3c(cc(CCCCC)c1)C1C(CCC(C)=C1)C(C)(C)OC(C2C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.562
CB1 binding score: -16.206
InChIKey:RNHVEAIVUDAIQU-UHFFFAOYSA-N
ID: 67540
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 67541
SMILES:Oc1cc(O)c(C)c2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.375
InChIKey:IBMBLYFCHCUZGW-UHFFFAOYSA-N
ID: 67542
SMILES:C1C=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.842
InChIKey:ZVZRSLDINWLUFX-UHFFFAOYSA-N
ID: 67543
SMILES:C1(C)C(C)=CC(C(OCC)=O)(C)C2C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -12.364
InChIKey:RJOZCCGEPCVFJD-UHFFFAOYSA-N
ID: 67544
SMILES:c1(CCC)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 67545
SMILES:c1c(O)cc(C)c2c1OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.346
InChIKey:GGFBUEDIKGICRY-UHFFFAOYSA-N
ID: 67546
SMILES:O1c2cc(CCCCCC)cc(O)c2C2C(CCC(C)=C2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 67547
SMILES:O(CCOC)c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -14.029
InChIKey:QUFCXICNYOZPES-UHFFFAOYSA-N
ID: 67548
SMILES:O=C1c2c(O)cc(CCC)cc2OC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.649
InChIKey:TVTGGHAKBCHXRZ-UHFFFAOYSA-N
ID: 67549
SMILES:CC1(C)C(CC=C(C)C)CC(CC(=C(C)C)Cc2c(O)cc(CCc3ccccc3)c(O)c2)=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.74
CB1 binding score: -16.862
InChIKey:GUOIUILKZKINET-UHFFFAOYSA-N
ID: 67550
SMILES:CC1(O)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.523
InChIKey:NIBMZWXYVNTLQQ-UHFFFAOYSA-N
ID: 67551
SMILES:C1C(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 67552
SMILES:C(CCCCCc1cc2c(c(O)c1)CC(C(=C)C)CC2)c1ccc(O)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -11.949
InChIKey:IAKSGFWAIIIGCU-UHFFFAOYSA-N
ID: 67553
SMILES:C1C2(c3cc(O)ccc3O1)C(C(=CC)C)C(C(C(CCC)C)C(C)O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.543
InChIKey:QVUHUDXKJQSHRC-UHFFFAOYSA-N
ID: 67554
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1CCC(C)(O)C(CCC(C)=C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.148
InChIKey:LLPSAXJFRMGFIZ-UHFFFAOYSA-N
ID: 67555
SMILES:C(CCCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.648
InChIKey:ULSRTFKGNQFBNQ-UHFFFAOYSA-N
ID: 67556
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.722
InChIKey:MXHMUXCJWMFOAM-UHFFFAOYSA-N
ID: 67557
SMILES:C(c1cc(O)c2c(c1O)OC1(C)CCC3C(C)(C)CC3C2=CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.258
InChIKey:LBBPCUBFUPTVAR-UHFFFAOYSA-N