ID: 109411
SMILES:C12C(CO)(C)C1Cc1c(cc(C)c(O)c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.306
InChIKey:ZIFFAXGZGMSUPJ-UHFFFAOYSA-N
ID: 109412
SMILES:C(CCCCCCCCCCC)CCc1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(C(=O)CC(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.829
CB1 binding score: -13.846
InChIKey:UIOSELXTVXGZED-UHFFFAOYSA-N
ID: 109413
SMILES:C(c1c(O)c(O)c2c(c1)OC(C)(C)C1=C2CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.69
InChIKey:HMUKBZYENXCGGD-UHFFFAOYSA-N
ID: 109414
SMILES:C(Cc1c(O)c2c3c(c(O)cc13)C1C(C(C)(C)O2)CCC(C)C1=O)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.502
InChIKey:UETLOYAIYNQFGM-UHFFFAOYSA-N
ID: 109415
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C(=O)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.994
InChIKey:GJVSBAWKKHVKBM-UHFFFAOYSA-N
ID: 109416
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.93
InChIKey:KYZZGUCXNYLZKE-UHFFFAOYSA-N
ID: 109417
SMILES:Oc1cc(CCCCC)cc2c1OC(CC1C(=C(C)C)CCC1C)C(=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.655
InChIKey:UVAKOAARZOIYST-UHFFFAOYSA-N
ID: 109418
SMILES:C(CCCC)c1cc(O)c2c(c1)C(C(=C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -17.507
InChIKey:MPSQFQPXBKHQBO-UHFFFAOYSA-N
ID: 109419
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCC)c(C=O)c(O)c3C2C1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: Not available
InChIKey:JYRJBCRTQIPDHI-UHFFFAOYSA-N
ID: 109420
SMILES:C1CC(C(C)=C)C(c2cc(CCCC)ccc2O)C(C(C)(O)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.861
InChIKey:DWWGPTQFEGRDOI-UHFFFAOYSA-N
ID: 109421
SMILES:Oc1c(O)c2c(cc1CC)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.904
InChIKey:BHLKVEKQBLQHPO-UHFFFAOYSA-N
ID: 109422
SMILES:c1(OC)cc(O)cc(CCc2cc(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -15.929
InChIKey:DDMMGHWGYDGFMH-UHFFFAOYSA-N
ID: 109423
SMILES:C1(C)C2C(C=C(C)C(O)C2)c2c(O)c(C(O)=O)c(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -11.627
InChIKey:XAOJQZQSTVIORD-UHFFFAOYSA-N
ID: 109424
SMILES:C(CC)CCc1cc(O)c(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.334
InChIKey:VEBHZTTZGZYZIW-UHFFFAOYSA-N
ID: 109425
SMILES:c1(O)cc(C2C(C(=C)C)CCC(C)=C2)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 109426
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 109427
SMILES:C1(O)C(C)(C)OC(c2ccc3c(c2)OC(CCC=C(C)C)(C)C=CC3)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -18.514
InChIKey:MHKOWKDJXLPACG-UHFFFAOYSA-N
ID: 109428
SMILES:C1(C(=CCC=C(C)C)C)CCC(C)=CC1c1c(O)c(C(=O)C)c(O)cc1CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.712
InChIKey:WMBLYILWPXUREV-UHFFFAOYSA-N
ID: 109429
SMILES:C(C)(=CC(CC(C)=CCc1c(O)cc(CCCCC)cc1O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -17.947
InChIKey:ZXDVFJZNEMZQLZ-UHFFFAOYSA-N
ID: 109430
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1cc(O)c(C)cc12)C(CC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -16.204
InChIKey:ANVZYCGUDFEQRG-UHFFFAOYSA-N
ID: 109431
SMILES:C(C)(=CCCC(=CCc1c(O)cc(C)c(C2C=CC(C=C)(C)CC2)c1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.044
InChIKey:ZAKKZYQQTOMWIE-UHFFFAOYSA-N