ID: 50737
SMILES:Oc1c(CC=C(C)C)c(-c2ccccc2)c(O)c2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -14.193
InChIKey:OLGKVQMPRAFCQI-UHFFFAOYSA-N
ID: 50738
SMILES:C(Cc1cc(O)c(C2C(C(=C)C)CCC(C)C2)c(O)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.27
InChIKey:NHRQPZVTJJSDJT-UHFFFAOYSA-N
ID: 50739
SMILES:CC12CC(C(C(C)O)(C)C13C4C2c1c(cc(CCCCC)cc1O)OC4)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.99
InChIKey:LUCXTBOIWXYIAC-UHFFFAOYSA-N
ID: 50740
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 50741
SMILES:C1C(O)C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 50742
SMILES:CC(C)CC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.055
InChIKey:OAEMYZLSFWZUEY-UHFFFAOYSA-N
ID: 50743
SMILES:c1(CCCCC)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.615
InChIKey:CRXGOYTUACLVFE-UHFFFAOYSA-N
ID: 50744
SMILES:O=Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=CCCC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.287
InChIKey:BLDRZNWHLXEXQN-UHFFFAOYSA-N
ID: 50745
SMILES:O(C)c1c2c(cc(CCCCC)c1)OC1(C)CC2C(=C)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.391
InChIKey:MRQPSRJPVVNBJC-UHFFFAOYSA-N
ID: 50746
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 50747
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50748
SMILES:CC1CC(C=C(C)C)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.521
InChIKey:CUHXPWBIPBKJKU-UHFFFAOYSA-N
ID: 50749
SMILES:C(C(O)c1cc(O)c(C2C=C(C)C(CC=C(C)C)O2)c(O)c1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -18.847
InChIKey:RSLBZWRDISNJOT-UHFFFAOYSA-N
ID: 50750
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.454
InChIKey:VZFRXICVQKCJBK-UHFFFAOYSA-N
ID: 50751
SMILES:C(CC(=CCCC1(C)Oc2c(c(O)c(C(=O)O)c(CCCCC)c2)C(O)C1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -15.924
InChIKey:FXCDZUQMWVGJGC-UHFFFAOYSA-N
ID: 50752
SMILES:C(C)(=CCCC(CO)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.792
InChIKey:FELSFDDOTYDITC-UHFFFAOYSA-N
ID: 50753
SMILES:COc1c(C2C(O)C(O)C(O)C(CO)O2)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.501
CB1 binding score: -16.74
InChIKey:ODKLNKFSLRUOAG-UHFFFAOYSA-N
ID: 50754
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(O)C)OC(C)(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.136
InChIKey:SPIMEEFNYUFSEC-UHFFFAOYSA-N
ID: 50755
SMILES:C1c2c(ccc(C)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -14.99
InChIKey:DOXAJCHMNLLIMX-UHFFFAOYSA-N
ID: 50756
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)CC1)C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.409
InChIKey:FQGHANNVNIIMMR-UHFFFAOYSA-N
ID: 50757
SMILES:C12(C)Oc3cc(CCCC)c(O)c(O)c3C1C13CCC(C(C=CC=C(C)C)(C)OC1=O)C3CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -12.741
InChIKey:OCXSXSXXNDDNEF-UHFFFAOYSA-N