ID: 67054
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1=CC(=O)C(C)(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.502
InChIKey:GLSYAEMXTWVJQP-UHFFFAOYSA-N
ID: 67055
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C(C)(CCC(C(C)C)=C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.661
InChIKey:MGCBFVOYAUQFBX-UHFFFAOYSA-N
ID: 67056
SMILES:c1(S(=O)(C=CC(C)C)=O)cc(O)c2c3c1OC(C)(C)C1CCC(C)(O3)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.49
CB1 binding score: -14.67
InChIKey:MDSLCYCLONMFAI-UHFFFAOYSA-N
ID: 67057
SMILES:C1(Br)C(C)(C)Oc2cc(CCC)cc(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids;Merohemiterpenoids
MW: 313.191
CB1 binding score: -15.765
InChIKey:CDGXPTNVQLERMO-UHFFFAOYSA-N
ID: 67058
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 67059
SMILES:C(C(C)=CCCC1(C)C(C)Oc2c(c(O)cc(CCCCC)c2)C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -13.518
InChIKey:HZJAJULZHIUMTH-UHFFFAOYSA-N
ID: 67060
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 67061
SMILES:c12c(cc(CCCCC)cc1O)OC(C(O)(C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 67062
SMILES:c1(O)c2c(c(COC(C)=O)c(CC(C)O)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.513
InChIKey:LORPNXBFGMONDN-UHFFFAOYSA-N
ID: 67063
SMILES:C1=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 67064
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C(=O)OC)c(CCCCC)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.721
InChIKey:GSKFGOCWICCZJN-UHFFFAOYSA-N
ID: 67065
SMILES:c1(CCCCC)c(O)c(C(O)=O)c2c3c1C(C)(C=CC(C(O)(C)C)O3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -13.53
InChIKey:WLESMVBQHFQQLD-UHFFFAOYSA-N
ID: 67066
SMILES:C(c1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 67067
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 67068
SMILES:C(c1cc(OC)c2c(c1)OC1(C)CC2C(C(C)(C)OC(C)=O)CC1)C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -15.291
InChIKey:YDNIGEFPABFWQX-UHFFFAOYSA-N
ID: 67069
SMILES:OCC1=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: 67070
SMILES:c1(C(C)(C)OC(CCCCCCCCC)=O)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.397
InChIKey:LVPZGERDHZAKLO-UHFFFAOYSA-N
ID: 67071
SMILES:O1c2c(c3c(cc(CCCCC)cc3)OC2(C)C)C(O)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.421
InChIKey:XTIGHMRVAWZKGD-UHFFFAOYSA-N
ID: 67072
SMILES:C(C1C(C)(C)CCCC1C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -16.917
InChIKey:DQDPAPFZTKDTDS-UHFFFAOYSA-N
ID: 67073
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 67074
SMILES:C=C1CCC2C(C)(C)Oc3c(c(OC(=O)C)cc(CCCCC)c3O)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.879
InChIKey:PLWTUDKCZLBIHY-UHFFFAOYSA-N