ID: 47020
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 47021
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(ccc(Cl)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.78
CB1 binding score: -17.634
InChIKey:BOOFNWUGVKUHFW-UHFFFAOYSA-N
ID: 47022
SMILES:CC1(C)CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.644
InChIKey:WJCQHIPQASZTHB-UHFFFAOYSA-N
ID: 47023
SMILES:COCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.379
InChIKey:ZGIZACIHJBBJLO-UHFFFAOYSA-N
ID: 47024
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 47025
SMILES:C(=O)(OC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.648
InChIKey:OTFNAKLRKKCSJT-UHFFFAOYSA-N
ID: 47026
SMILES:CC(CCC=C(C)CCC=C(C)C)=CCc1c(O)cc(CC(O)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 372.549
CB1 binding score: -16.85
InChIKey:KRJSETCRDBBKGS-UHFFFAOYSA-N
ID: 47027
SMILES:C1CCC2(O)Cc3c(O)cc(CCCCC)cc3OC2(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.61
InChIKey:OGBZSPORUQOCBH-UHFFFAOYSA-N
ID: 47028
SMILES:C(C(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 47029
SMILES:CC(=Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -17.167
InChIKey:WKOHVHAUIZFSCK-UHFFFAOYSA-N
ID: 47030
SMILES:c1(C=Cc2ccccc2CC)c(O)c(C2C=C(C)CCC2C(=C)C)c2ccc3c(c2c1)OC(C)(C)C1CCC(C)=CC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 558.806
CB1 binding score: -15.396
InChIKey:WWPGVBABEBJIKM-UHFFFAOYSA-N
ID: 47031
SMILES:c1(OC)cc2c(cc1CCCCC)OC(C)(C)C1(O)C2=C(C(C)C)CC(O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.019
InChIKey:HJYAERBLVHRIBN-UHFFFAOYSA-N
ID: 47032
SMILES:C(C)CCC(O)CCCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.667
InChIKey:RESXAAQCYWVUIZ-UHFFFAOYSA-N
ID: 47033
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)(C=C)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.006
InChIKey:IUMUREQSRZQTCF-UHFFFAOYSA-N
ID: 47034
SMILES:c1(OC)c(O)c(C)cc2c1C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.655
InChIKey:AJYJHTPAYYATNI-UHFFFAOYSA-N
ID: 47035
SMILES:C1c2c(cc(CCCCC)cc2O)OC2(C)C1C(C(C)=C)CC(OC)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.25
InChIKey:LFNXVQUIOLTDDM-UHFFFAOYSA-N
ID: 47036
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)-c2c(CC=C(C)C)c(O)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.929
InChIKey:LUJCTVYKPDNCTB-UHFFFAOYSA-N
ID: 47037
SMILES:C1(OC)(C)C2C(Cc3c(OC(C)=O)cc(C(C)C(CCCCC)C)cc3O2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.168
InChIKey:VSLYXTDYUNRZIY-UHFFFAOYSA-N
ID: 47038
SMILES:C12C(C)(CCC(O)C1(C)C)Oc1cc(CCCCC)c(C(=O)OC(C)(C)C)cc1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.908
InChIKey:LWCGBYFIJSDGJZ-UHFFFAOYSA-N
ID: 47039
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 47040
SMILES:CC(C=C)c1cc2c(cc1)C(C)(C)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -14.877
InChIKey:XRKIZMHGXSAELQ-UHFFFAOYSA-N