ID: 72703
SMILES:CC1(C)C2C(C=C(C)C(O)C2)c2c(cc(C)cc2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.155
InChIKey:MXSWDTMEPHWSDH-UHFFFAOYSA-N
ID: 72704
SMILES:Oc1c2c(cc(CCC(=O)C=C(C)C)c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: Not available
InChIKey:WRFKBSBSAGISFJ-UHFFFAOYSA-N
ID: 72705
SMILES:c1(O)c(C2=C3C4C3C(=C)C2CC4C(C)(C)O)ccc(CCCCCCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -12.91
InChIKey:DUNNHWFCJSRPFJ-UHFFFAOYSA-N
ID: 72706
SMILES:c1(CCCC)c(O)c(C(C)=O)c(O)c2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.379
InChIKey:MGMNSDBZWVDPHZ-UHFFFAOYSA-N
ID: 72707
SMILES:C1CC2(Cc3c(O)cc(CCC)cc3O2)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -14.199
InChIKey:UGDRHRHPKALUAM-UHFFFAOYSA-N
ID: 72708
SMILES:C(OP(=O)(O)O)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.34
CB1 binding score: -15.071
InChIKey:LJZPCFGCMXQEMO-UHFFFAOYSA-N
ID: 72709
SMILES:C(=O)(C)Oc1c(C2C(C(C)C)CCC(C)=C2)c(CCCCC)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.053
InChIKey:QUKLSINXHZEHOI-UHFFFAOYSA-N
ID: 72710
SMILES:CC(C)=CCCC(C(CCC(C)=CCCC(=CCc1c(OS(=O)(O)=O)c(C)cc(Oc2ccccc2)c1)C)C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.819
CB1 binding score: -13.521
InChIKey:FPNIXXQFDNYHNP-UHFFFAOYSA-N
ID: 72711
SMILES:Oc1cc(O)c(=O)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -14.111
InChIKey:YDQUUQBCXIZHDP-UHFFFAOYSA-N
ID: 72712
SMILES:CC(C)CCc1cc2c(c(O)c1C)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.189
InChIKey:CNYHOXVPBQPULM-UHFFFAOYSA-N
ID: 72713
SMILES:C(C(O)C1C(C)(C)O1)(O)C(C)=CCCC1(C)Oc2c(C)cc(O)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.356
InChIKey:CYSMSBSOXPQLFS-UHFFFAOYSA-N
ID: 72714
SMILES:C1(C)(C)Oc2cc(O)c(C(=O)C(C)CC)c(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.563
InChIKey:KFHWFLUEGBMEIL-UHFFFAOYSA-N
ID: 72715
SMILES:C1(=O)OC(CC(C)=CCc2c(CCCCC)cc(O)c(O)c2O)C=C1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -13.692
InChIKey:FRPKMPURGKYINJ-UHFFFAOYSA-N
ID: 72716
SMILES:Cc1ccc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.589
InChIKey:ILPMEUDSBVWXIW-UHFFFAOYSA-N
ID: 72717
SMILES:C1=C(C)C(C(C)=CC)C(CC)(C)Oc2c1cccc2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -15.635
InChIKey:SGDRZJQEGXPUGN-UHFFFAOYSA-N
ID: 72718
SMILES:c1(O)cc(O)c(CC=C(C)CCC=C(C)C)cc1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 316.485
CB1 binding score: -17.394
InChIKey:MYUUBTAELPINEG-UHFFFAOYSA-N
ID: 72719
SMILES:C1=C(C)CCC=C(C)CCC(C(C)(C)O)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.065
InChIKey:NAXGTLRUVSLFTF-UHFFFAOYSA-N
ID: 72720
SMILES:CC1(O)CCC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.679
InChIKey:PLONCQVTGGBUST-UHFFFAOYSA-N
ID: 72721
SMILES:C(CCCc1cc2c(c3c1OC1(C)CCC3C(C)(CCC=C(C)C)O2)c2c(nc1)-c1ccccc1N(C)C2C(=O)OC)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.812
CB1 binding score: -12.996
InChIKey:LCGINFGVTCWXAS-UHFFFAOYSA-N
ID: 72722
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCCO)cc2O)C1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.943
InChIKey:VXGKLDGOVIXPAH-UHFFFAOYSA-N
ID: 72723
SMILES:c1(O)cc(CCCCC)cc2c1OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.747
InChIKey:GZXQAMTZYAIVIP-UHFFFAOYSA-N