ID: 72052
SMILES:CC(C)CC(=O)c1cc(O)c(C2C=C(C)CCC2C(C)C)c(OC(CCCCCCC)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.473
InChIKey:IUVPPVCTZHHCQE-UHFFFAOYSA-N
ID: 72053
SMILES:C12=C(OC(C)(C)C3CCC(C)=CC3C1=O)C(OC(C)=O)C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.844
InChIKey:NLVRBIZAPVTBEE-UHFFFAOYSA-N
ID: 72054
SMILES:C1=C(C)CCC(C(C)(O)C)C1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 72055
SMILES:C1C2C(CC(C)=C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 72056
SMILES:c1(CC=C(CCC=C(CCC=C(C)C)C)C)cc(O)c(C2C=C(C)CCC2C(=C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.692
CB1 binding score: -15.621
InChIKey:NHDDQLQYUSJSOR-UHFFFAOYSA-N
ID: 72057
SMILES:C1C2C3(COC(C2(C)C)CC2c4c(cc(CCCCC)cc4O)OC(C)(C)C3C2)C(=O)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -15.531
InChIKey:XIANSWSZORBILY-UHFFFAOYSA-N
ID: 72058
SMILES:C1(C)=C(c2c(C)cc(O)cc2CCCC)CC(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.305
InChIKey:ZJXQMEJPKZZGAP-UHFFFAOYSA-N
ID: 72059
SMILES:C12(C)OCC(C)(C1CCC(C)=O)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.193
InChIKey:XDIRXJIBLHHOIC-UHFFFAOYSA-N
ID: 72060
SMILES:C1(C)=CC2c3c(C)c(O)cc(C(C=C(C)C)O)c3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.549
InChIKey:GTAXSMBJPLDTIB-UHFFFAOYSA-N
ID: 72061
SMILES:C(CCc1cc(O)c2c(c1)OC1(C)CCC(C(C)=C)C12)C=CC(OC)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.606
InChIKey:KJWURYNCNGMIKE-UHFFFAOYSA-N
ID: 72062
SMILES:c1(O)c2c(cc(CCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 72063
SMILES:C(=C(C)CCC=C(C)C)Cc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 72064
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 72065
SMILES:C1(=C(C)C)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.559
InChIKey:YLQNECUCNOYIKC-UHFFFAOYSA-N
ID: 72066
SMILES:Oc1cc(OC)c2c(c1CC=C(C)C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.166
InChIKey:KSOPSHXBMOJIAF-UHFFFAOYSA-N
ID: 72067
SMILES:O=C(OC)c1c(CCCCC)c(O)c2c(c1)C1C(C(C)(C)O2)CC=C(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.595
InChIKey:VCRZDPGZHJOWNC-UHFFFAOYSA-N
ID: 72068
SMILES:C1Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 192.258
CB1 binding score: -17.99
InChIKey:CBNHBFQWUZBCDS-UHFFFAOYSA-N
ID: 72069
SMILES:c1(CCCCCC)cc(O)c(C2C=C(C(CC(=O)CC=C(C)C)C)C(O)C(OC(C)=O)C2C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -14.796
InChIKey:ADSMEEHYHZUICU-UHFFFAOYSA-N
ID: 72070
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 72071
SMILES:C1C(O)(C)C2C(C1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.782
InChIKey:CFJOFYMFLMHFLW-UHFFFAOYSA-N
ID: 72072
SMILES:C(CC)CCC(=O)Oc1c2c(c(O)c(C(CC(C(O)C(CC)C)C)=O)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.702
CB1 binding score: -17.205
InChIKey:NHZOQHOSIMMFQJ-UHFFFAOYSA-N