ID: 104749
SMILES:C(C(C)=CCc1c(O)cc(CCCCCCCCC)cc1OC)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -16.856
InChIKey:PJALFOMIAWDOLD-UHFFFAOYSA-N
ID: 104750
SMILES:C1(C)C=CC(C)(C)C2Oc3cc(CCCCC)cc(O)c3C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.932
InChIKey:RXTCGBSJQQRIKL-UHFFFAOYSA-N
ID: 104751
SMILES:Oc1cc2c(c(C)c1)C=CC(CCC=C(C)CCC=C(C)[CH])(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -17.903
InChIKey:RCLLFZLAEOITBW-UHFFFAOYSA-N
ID: 104752
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 104753
SMILES:CC(OC1COC(Oc2c(O)c3c(cc2C)OC(C)(C)C2CCC(C)=CC32)C(O)C1OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.539
CB1 binding score: -16.004
InChIKey:SPEBYLSBURJMEF-UHFFFAOYSA-N
ID: 104754
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(C(=O)O)C2C(C)(C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.367
InChIKey:KDIIMKLRPUNNDZ-UHFFFAOYSA-N
ID: 104755
SMILES:C12C(C(C)(C)Oc3ccc(O)c(C)c31)CC(=O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.875
InChIKey:MTFWSHCUKLFSDE-UHFFFAOYSA-N
ID: 104756
SMILES:c1c(O)cc(CC=C(C)C)c(O)c1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 104757
SMILES:c1c(CCCC(C)(OC)C)cc2c(c1O)C1=CC(=O)CC(C)(C)C1(C=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -13.641
InChIKey:VKXIUMKEVIZKMG-UHFFFAOYSA-N
ID: 104758
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(OC)c1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.331
InChIKey:OHWIQAZYGSCYAJ-UHFFFAOYSA-N
ID: 104759
SMILES:N(CCc1cc(C2C=C(CO)CCC2C(C)=C)c(O)cc1)=CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.441
CB1 binding score: -12.256
InChIKey:VWYDZJIUMDGNLZ-UHFFFAOYSA-N
ID: 104760
SMILES:c12c([O-])c(C(=O)C)c(O)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.362
CB1 binding score: -17.385
InChIKey:KJAIZRHSRWNTDV-UHFFFAOYSA-M
ID: 104761
SMILES:C1(C2(C)OC(C)(C)C(O)CC2)CCC(CO)=CC1c1c(O)cc(CCCCC)cc1OC=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -12.321
InChIKey:KZJPBQXLYFZRLB-UHFFFAOYSA-N
ID: 104762
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C(=O)CC(C)(O)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.457
InChIKey:XBIYSPOCSWYCHO-UHFFFAOYSA-N
ID: 104763
SMILES:C1(C)(C)Oc2ccc(O)cc2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 104764
SMILES:COc1cc(CCCCC)cc2c1C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.239
InChIKey:UZKGLBDVRIILHT-UHFFFAOYSA-N
ID: 104765
SMILES:Oc1c(CC)c2c(cc1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.43
InChIKey:USFXVPSKCJXLDW-UHFFFAOYSA-N
ID: 104766
SMILES:c1(C(OC)C(O)(C(=O)O)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -14.695
InChIKey:VKHYOIDHSCGQPU-UHFFFAOYSA-N
ID: 104767
SMILES:C12C(C)(C(=O)O)C(C1c1c(OC)cc(CCCCC)cc1OC)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.129
InChIKey:OKRYLHVTGSQENP-UHFFFAOYSA-N
ID: 104768
SMILES:c1(O)cc2c(c(OC)c1)C(=O)OC(C)(C)C1C2CC(C)C12CCC(CO)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.84
InChIKey:RTPWKRYLTZZCSD-UHFFFAOYSA-N
ID: 104769
SMILES:Cc1c(C=O)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -14.348
InChIKey:PTCAUSMDZRUFLB-UHFFFAOYSA-N