ID: 111616
SMILES:CC(=O)OC1C(C)=CC2c3c(cc(CCCCC)cc3OC(=O)C=C(C)C)OC(C)(C)C(C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.998
InChIKey:SWXYAVXJILRMAZ-UHFFFAOYSA-N
ID: 111617
SMILES:C(C=C(C)C)C1c2c(O)cc(CCC)cc2OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 304.43
CB1 binding score: -15.62
InChIKey:ULXQBXIEEKVUHW-UHFFFAOYSA-N
ID: 111618
SMILES:C1(C)(C)C(=O)C2(CC(C)C3C(C(O)C4(C)Oc5cc(CCCCC)cc(O)c5C3C4)CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.03
InChIKey:YBWAZUIQWMHXSL-UHFFFAOYSA-N
ID: 111619
SMILES:C(C)(=CCc1c(OC)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -18.913
InChIKey:GDBWRAFIFHBEOL-UHFFFAOYSA-N
ID: 111620
SMILES:Oc1cc(CCC)cc2c1C1=C(CC(C)(C)O1)C(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.502
InChIKey:SUZJOHXILMTDQP-UHFFFAOYSA-N
ID: 111621
SMILES:C(C(O)C(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1OC)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -17.456
InChIKey:FLHZDEFPQMYKGX-UHFFFAOYSA-N
ID: 111622
SMILES:C1C2C3(Oc4cc(CCCCC)cc(O)c4C3C=C(C)C1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: Not available
InChIKey:HXVLENJSYHXVGQ-UHFFFAOYSA-N
ID: 111623
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC(=O)C)OC(CCCCC)C=CC2(OC)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -12.671
InChIKey:OSMANMCZWXRSLG-UHFFFAOYSA-N
ID: 111624
SMILES:C(=C(C)CCC=C(C)C)CC1Oc2cc(CCCCC)cc(O)c2C2C(C(=C)CCC3C(C)(C)CC13)C2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.81
CB1 binding score: -13.847
InChIKey:UZHBEXSBGDLWHY-UHFFFAOYSA-N
ID: 111625
SMILES:CC1CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 111626
SMILES:O(c1cc(C)cc2c1C=CC(C)(CCC=C(CCC1OC1(C)C)O)O2)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -19.437
InChIKey:XUEJEOOJPZVXEH-UHFFFAOYSA-N
ID: 111627
SMILES:C(c1c(O)cc2c(c1)OC(C)(C)C1C2CC(CO)=CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -17.334
InChIKey:YTVRVIWEMUSFAJ-UHFFFAOYSA-N
ID: 111628
SMILES:c1c2c(cc(CCCC)c1)OC(C)(C)C1CCC(C=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.699
InChIKey:IXZSGOBNBPHSIK-UHFFFAOYSA-N
ID: 111629
SMILES:C(C(C)C(C)C)(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.9
InChIKey:AUAHKFUBGNNVKM-UHFFFAOYSA-N
ID: 111630
SMILES:C(C)(C)=CCCC(C)=CCc1c(O)cc(CCCc2cc(O)cc(O)c2CC=C(C)CCC=C(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 532.765
CB1 binding score: -15.381
InChIKey:PXGBEBPPTDDHBB-UHFFFAOYSA-N
ID: 111631
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C(=O)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -15.886
InChIKey:OXKDIXGKBVCFAK-UHFFFAOYSA-N
ID: 111632
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CCC(C)=C1)C(C)=CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.009
InChIKey:MUFNDOALPIKXDE-UHFFFAOYSA-N
ID: 111633
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 111634
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 111635
SMILES:C(=CCCC1(C)Oc2cc(CCCCC)cc(O)c2CC1=O)=CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.651
InChIKey:YJSHNXHLUDHPOG-UHFFFAOYSA-N
ID: 111636
SMILES:C1(C)(C)C2=C3C(C)(CC(O)C(C)=CC3OC(c3c(O)cc(CCCCC)cc3O)=C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -16.943
InChIKey:JWLLSFYEPZAWIO-UHFFFAOYSA-N