ID: 108886
SMILES:C12(C)Oc3c(c(O)cc(C)c3)CC1C=C(CC=C(C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -13.99
InChIKey:SITAJLZGGWNALI-UHFFFAOYSA-N
ID: 108887
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)=C)CC(CC1)C2C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.287
InChIKey:GNMVSOPAAOTRJB-UHFFFAOYSA-N
ID: 108888
SMILES:c1c(C2(O)Cc3c(cc(CCCCC)cc3OC)OCO2)c(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.67
CB1 binding score: -14.958
InChIKey:GOEGQYBMMSTAAH-UHFFFAOYSA-N
ID: 108889
SMILES:O1c2cc(CCCCC)cc(O)c2CC1C(=C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.846
InChIKey:NBVPTAKVRPHONU-UHFFFAOYSA-N
ID: 108890
SMILES:O(c1cc(C)cc2c1C1=CC(C)(C)OC3(C)CCC(C(C)=C)CC(O)C1(O2)C3O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.448
InChIKey:NMRRLXWLQJBBFK-UHFFFAOYSA-N
ID: 108891
SMILES:C(CCC(=C)C1Oc2c(c(O)cc(CCCc3ccccc3)c2)C1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.513
CB1 binding score: -15.929
InChIKey:IRKUYNIVOUVARR-UHFFFAOYSA-N
ID: 108892
SMILES:c1(C2C(C(=C)C)CC(O)C(C)=C2)c(O)cc(O)c(C(=O)CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.007
InChIKey:MKLUQFVLUBRRJZ-UHFFFAOYSA-N
ID: 108893
SMILES:C12CCC(C)=CC1c1c(cc(CCCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 108894
SMILES:c1(O)cc(C)c(C2C=C(C)CCC2C(C)=C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.502
InChIKey:PYYMFYMSJKXXFM-UHFFFAOYSA-N
ID: 108895
SMILES:C(C(=O)C(C)(C1CCC2(O)C(O)c3c(O)cc(C)cc3OC(C)(C)C2C1)OC(C)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.556
CB1 binding score: -16.401
InChIKey:XYABLVZMUCQBBW-UHFFFAOYSA-N
ID: 108896
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(C)C1(C)C(C)(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.893
InChIKey:UEHQNUKOPOEMFI-UHFFFAOYSA-N
ID: 108897
SMILES:C(CCCC)C12OC1C1=C(c3c(c(CCC4C5=CC(=O)CC(C)(C)C5)c(O)cc4C3=O)C(C)=CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.624
CB1 binding score: -13.18
InChIKey:MFHGPAGQEYZOHL-UHFFFAOYSA-N
ID: 108898
SMILES:C1(C)COc2c3c(c(OC(=O)C)c(CCCCC)c21)C=CC(C)(CCC=C(C)C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.993
InChIKey:HQVHCRMJHGHFSK-UHFFFAOYSA-N
ID: 108899
SMILES:CC(C)C1CCC2(C)CC3c4cc(CCCCC)cc(O)c4CC3C(=O)C(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -19.088
InChIKey:GEKXSFLXRRCLBB-UHFFFAOYSA-N
ID: 108900
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 108901
SMILES:COC1C=C(C)CC2(O)C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.273
InChIKey:ORCRRICIBWWJJT-UHFFFAOYSA-N
ID: 108902
SMILES:OC1C(C)C2C3c4c(cc(CCCCC)cc4OC2)OC2(C(=O)C3=C1O)CC1C(C)COC1(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.589
CB1 binding score: -15.94
InChIKey:WBZYXKJAKQZBRT-UHFFFAOYSA-N
ID: 108903
SMILES:C(c1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N
ID: 108904
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)c(O)cc(C(O)CCC(OC)=O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.671
InChIKey:FILAKPSLFDYKCU-UHFFFAOYSA-N
ID: 108905
SMILES:C1(=O)OC2CC(C)=CC1c1c(O)cc(CCCCC)c(C(=O)OC3C(C)(C)OCC(C(=O)OC)=CC3)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.598
CB1 binding score: -13.635
InChIKey:PTQKEKXUSZBULW-UHFFFAOYSA-N
ID: 108906
SMILES:CC(=CCc1cc(O)cc(CCCCC)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.792
InChIKey:LTMDLXPPVFFIFP-UHFFFAOYSA-N