ID: 18859
SMILES:CC1C2(C)Cc3c(O)cc(CCCCC)c(O)c3C(=O)C2CC(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.718
InChIKey:WSOLVHBGWMXPIB-UHFFFAOYSA-N
ID: 18860
SMILES:C12(C(O)CC(C)=CC1O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.69
InChIKey:XHWKWUYOEZNMCE-UHFFFAOYSA-N
ID: 18861
SMILES:OC1(C)CC2C(C(C)(C)Oc3cc(CCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.509
InChIKey:XAJXLANJASZEBB-UHFFFAOYSA-N
ID: 18862
SMILES:C1C(C)=CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.994
InChIKey:NUAFSIHBNPRBHS-UHFFFAOYSA-N
ID: 18863
SMILES:O=C1C2C(C)(CCC1C(C)=C)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.522
InChIKey:VRFIFZZSEQEAPV-UHFFFAOYSA-N
ID: 18864
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 18865
SMILES:C1C(C)(C)C2C(O)C3c4c(O)cc(CCCCC)cc4OC3(C)CC2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.543
InChIKey:NWDHTRHMDQSNEO-UHFFFAOYSA-N
ID: 18866
SMILES:O=C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C(NC(C(=CC=CC(C=CC=C(C)C)C)C)=O)C1)S(=O)(=O)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 573.752
CB1 binding score: -15.101
InChIKey:FXMGPSPLHXHSBX-UHFFFAOYSA-N
ID: 18867
SMILES:C1C2C(C)(C)Oc3c(c(OC)cc(O)c3C(NCCc3ccc(F)cc3)=S)C2C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 455.595
CB1 binding score: -15.259
InChIKey:SIGDRWGZSCJTPY-UHFFFAOYSA-N
ID: 18868
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 18869
SMILES:C(CCCC)c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 18870
SMILES:O=C(OC1CC=C(C)CC(C)(C)C1)Cc1c(OC)c(CCCCC)c(C=O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.831
InChIKey:MNLJCGMFZTVAOG-UHFFFAOYSA-N
ID: 18871
SMILES:C12(CC=C(C)C)C(=NC(C)CC)OC(C)(C)C1CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.49
CB1 binding score: -15.738
InChIKey:KFDFVOLGBMZLQJ-UHFFFAOYSA-N
ID: 18872
SMILES:C(=Cc1cc(=O)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.684
InChIKey:MCZSSYXJBDQYGB-UHFFFAOYSA-N
ID: 18873
SMILES:c1(OCc2cc(OC)c(O)cc2)c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCC(C)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -12.748
InChIKey:MTAYQDMOEFMARL-UHFFFAOYSA-N
ID: 18874
SMILES:c1(C(=O)CC(C)C)c2c(c(O)c(CC3C(C(=C)C)CCC(C)=C3)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -17.699
InChIKey:OBZZAAOPFSCIGL-UHFFFAOYSA-N
ID: 18875
SMILES:C(C(=CC(C=C(C)C)=O)C)Cc1c(O)c2c(c(C(=O)c3ccccc3)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.662
CB1 binding score: -15.916
InChIKey:IKYMJRKZBAMZJX-UHFFFAOYSA-N
ID: 18876
SMILES:C1CC(OC(C)=O)C(C)CC2c3c(O)cc(CCC=CCOC(=O)CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -16.116
InChIKey:BSQSNMXCRSAIDA-UHFFFAOYSA-N
ID: 18877
SMILES:O(C(C)=O)C1C2(C)CC3c4c(O)cc(CC)cc4OC(C)(C)C3CC2OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -13.123
InChIKey:QRQCBWAWNYDCCI-UHFFFAOYSA-N
ID: 18878
SMILES:C1(C)CCC(C(C)C)C(c2c(O)c(C(=O)O)c(CCCCC)cc2O)C1C(=C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.303
InChIKey:YWCNGOGATMAAGK-UHFFFAOYSA-N
ID: 18879
SMILES:C1(C(C)C)CCC(C)=CC1c1c(O)cc(O)cc1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.039
InChIKey:GTPUJILMBPKFCV-UHFFFAOYSA-N