ID: 54685
SMILES:O1C(C)CC2=C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.979
InChIKey:CHJVKXVIJKWPDN-UHFFFAOYSA-N
ID: 54686
SMILES:O1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.509
InChIKey:IVVMRLBJADNCTJ-UHFFFAOYSA-N
ID: 54687
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54688
SMILES:O=C(C(O)C)OC1C2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2O)C2C(C)(C)C(=O)CC2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.566
CB1 binding score: -17.899
InChIKey:BTQWVUBKNUPZMW-UHFFFAOYSA-N
ID: 54689
SMILES:C1(C(C)C)CCC(C)(O)C2C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.961
InChIKey:CNKSTABSFLNANJ-UHFFFAOYSA-N
ID: 54690
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(C)ccc32)CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -13.678
InChIKey:DKJJTVOLLCJIDW-UHFFFAOYSA-N
ID: 54691
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2cc(C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.07
InChIKey:JAQQPODSAWTCBC-UHFFFAOYSA-N
ID: 54692
SMILES:c1(CC=C)cc2c(cc1CO)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.591
InChIKey:OKZSZUOPWFAMMP-UHFFFAOYSA-N
ID: 54693
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 54694
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.8
InChIKey:RAYRUJHFLUVASM-UHFFFAOYSA-N
ID: 54695
SMILES:C1C(O)C(C)=CCC1C(C)(C)Oc1cc(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.687
InChIKey:GEBOVYXXNJWWBZ-UHFFFAOYSA-N
ID: 54696
SMILES:CCCCCc1cc2c(c(O)c1)C1C=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: 54697
SMILES:C(CC)Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.433
InChIKey:MJPPRLGWZMKUCA-UHFFFAOYSA-N
ID: 54698
SMILES:C1(C)CCC2(C(C)C)Oc3c(c(OC)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.754
InChIKey:VOPUHUUBYRFIJR-UHFFFAOYSA-N
ID: 54699
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 54700
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(=O)C1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.104
InChIKey:RUSNJCCUCAUYFM-UHFFFAOYSA-N
ID: 54701
SMILES:c1cc(O)cc2c1OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N
ID: 54702
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.165
InChIKey:VBYUZBSQYMNTJZ-UHFFFAOYSA-N
ID: 54703
SMILES:C1=C(C)CC(C(C(C)=C)C)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.274
InChIKey:INZQQZRRIABWCT-UHFFFAOYSA-N
ID: 54704
SMILES:C1(C)=Cc2c(c3c(cc2)cc(CCCCC)cc3O)C2C(C(C)=C)CCC(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.649
CB1 binding score: -14.605
InChIKey:WDZQKNPEEIMXSV-UHFFFAOYSA-N
ID: 54705
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -14.028
InChIKey:HSTCOFGYPYTLCB-UHFFFAOYSA-N