ID: 94060
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=CCCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -18.356
InChIKey:ZJPTYFKSUONYDF-UHFFFAOYSA-N
ID: 94061
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.723
InChIKey:WKFVIMFNRJVSJG-UHFFFAOYSA-N
ID: 94062
SMILES:c12cc(OC)cc(CCCC)c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.232
InChIKey:GJMCTUDCOBYGDX-UHFFFAOYSA-N
ID: 94063
SMILES:c12c(O)cc(CCCCC)c(C(=O)O)c1OC1C(C)(C)CCCC1(C)C2CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.746
InChIKey:USUOKSVYMGUFDH-UHFFFAOYSA-N
ID: 94064
SMILES:Oc1c(CC=C(CCC(O)C(C)(O)C)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.445
CB1 binding score: -17.726
InChIKey:VFRPPEAWJCUJJG-UHFFFAOYSA-N
ID: 94065
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(C)cc(Br)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -15.981
InChIKey:UODILYRBONFWNU-UHFFFAOYSA-N
ID: 94066
SMILES:C12C(C(C)(C)Oc3ccc(C(=O)O)cc31)CC(C)=CCc1c(C)cc(O)c(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.467
CB1 binding score: -16.18
InChIKey:FLBZQYCXNIDSBO-UHFFFAOYSA-N
ID: 94067
SMILES:c1c(O)c(C(=O)C(C(CC)C)=O)c2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -14.534
InChIKey:UWYXXORGNZJSMQ-UHFFFAOYSA-N
ID: 94068
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)OC)CCC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.919
InChIKey:FYBPZPOEGCTGRM-UHFFFAOYSA-N
ID: 94069
SMILES:CC1(C)CCCC1(c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -17.453
InChIKey:NIVAQGHPRXHFPI-UHFFFAOYSA-N
ID: 94070
SMILES:C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 94071
SMILES:O(c1c2c(cc(C)c1)OC(C)(C)c1c-2cc(C)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.355
CB1 binding score: -17.077
InChIKey:CNZXJNKAEYOACI-UHFFFAOYSA-N
ID: 94072
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=CCCCCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.288
InChIKey:BCLYVNDTFWMCTD-UHFFFAOYSA-N
ID: 94073
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 94074
SMILES:CCCC(c1c(O)c(CC(=O)OCC)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.606
InChIKey:LMOQIRQMLACFSI-UHFFFAOYSA-N
ID: 94075
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 94076
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 94077
SMILES:OC(=O)C12C(CC=C1COC)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.516
InChIKey:ODPQYNULMRIFOM-UHFFFAOYSA-N
ID: 94078
SMILES:C(CC(=CCc1c(O)c(C)cc(OC)c1)C)C=C(C)C(C1C(CO)COC1=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -15.588
InChIKey:ACWFBIVTVJYADD-UHFFFAOYSA-N
ID: 94079
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 94080
SMILES:c1(O)c(C(O)=O)c(CCCCC)cc2c1OC1C(C)(CCC3C(C)(CCC=C(C)C)C3CCC(C)=C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.715
CB1 binding score: -15.12
InChIKey:ZECXNTREQWIBHK-UHFFFAOYSA-N