ID: 75643
SMILES:C12C(C)(CCC(=C)CC1C(=O)OC)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -12.705
InChIKey:PCPOHZKZFCLHBG-UHFFFAOYSA-N
ID: 75644
SMILES:C(Cc1cc(C(O)=O)cc2c1OC(C)(C)C1CC=C(C(OC)=O)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -13.176
InChIKey:IHXGUYMGKAXNGD-UHFFFAOYSA-N
ID: 75645
SMILES:C(=C(C)C)CC1C2c3c(O)cc(CCCCC)cc3OC(C2(O)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.738
InChIKey:LCIHELVYSALMGE-UHFFFAOYSA-N
ID: 75646
SMILES:CC1(C)C2=C(C)CCC13C(c1c(cc(CCCCC)cc1O)O3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.567
InChIKey:GDCSCMGULLCNIK-UHFFFAOYSA-N
ID: 75647
SMILES:C1=C(C)CCC2C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 75648
SMILES:C=C1C2C(CC(C)=CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C32)C2CC(C)CC1C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.701
CB1 binding score: -15.63
InChIKey:PFJXWVRIIRBMLK-UHFFFAOYSA-N
ID: 75649
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: 75650
SMILES:C(C)(=O)OC(CC1(C)c2c(cc(C)c(O)c2)OC(C)(C)CC1)C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.213
InChIKey:RBYUKPLNIGUDQB-UHFFFAOYSA-N
ID: 75651
SMILES:C1(c2c(OC)cc(CCCC)cc2O)C(CCC(=C)C)C(C)=CCC1Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -15.358
InChIKey:XNCKGVHCQXWVKA-UHFFFAOYSA-N
ID: 75652
SMILES:C(c1c(O)cc(C)c2c1CC(C(C)(C)O)C(C)C2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -13.417
InChIKey:URLOUIYFSAKRKR-UHFFFAOYSA-N
ID: 75653
SMILES:c1c2c(c3c(c1O)CCOC3=O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -14.965
InChIKey:COLOZUBJKCXJJT-UHFFFAOYSA-N
ID: 75654
SMILES:Oc1c2c(cc(CCCC)c1)OC(C)(C)C1C3C(CCC(C)(O)C3O)C(O)(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -14.358
InChIKey:KWJAEMCOYFPNHW-UHFFFAOYSA-N
ID: 75655
SMILES:C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 75656
SMILES:C(C)(=CCCC(C)=CCCC(=CCc1c(O)c(O)cc(CCCCC)c1)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -17.409
InChIKey:ABHCXJLDCYXJCS-UHFFFAOYSA-N
ID: 75657
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.745
InChIKey:VRZWHTKBFZGYJJ-UHFFFAOYSA-N
ID: 75658
SMILES:C(C1CC=C(C)COc2c1c(O)cc(CCCCC)c2)C(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.627
InChIKey:LEDBXNQYFYZFQC-UHFFFAOYSA-N
ID: 75659
SMILES:C(CC=C(C)CCC=C(C)C)C1(C)Oc2c(c3c(c(O)c2)cc(CCCCC)cc3O)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -13.291
InChIKey:DKEDXFNIUGYTSL-UHFFFAOYSA-N
ID: 75660
SMILES:C12Cc3c(O)cc4c(c3OC13OC(C(O)(C)O2)C3)CC1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O4)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.676
CB1 binding score: -16.502
InChIKey:PGGURJLYCROVSH-UHFFFAOYSA-N
ID: 75661
SMILES:c1(CCCC(CC)C)cc(OCC2OCCO2)cc(OC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -13.919
InChIKey:CEXVECSVSNZDEK-UHFFFAOYSA-N
ID: 75662
SMILES:C(CC1(C)C=CCC(C)(COC(=O)C)C1)CC(=CCc1c(O)c(C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -12.886
InChIKey:VCUBLMLLBJOLEO-UHFFFAOYSA-N
ID: 75663
SMILES:c1c(C)c(Cc2c(O)cc(CCCCC)cc2O)c(O)c2c1OC1(C2)C(C)CCC2C(C)(C)CCCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Spriromeroterpenoids
MW: 520.754
CB1 binding score: -10.44
InChIKey:MATWKZYFPFWJHA-UHFFFAOYSA-N