ID: 98743
SMILES:C(CCCc1cc(O)c2c(c1)C1C(C)(CC(O)C=C1)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.965
InChIKey:FZURSIGBZQAOKH-UHFFFAOYSA-N
ID: 98744
SMILES:CC(C)(c1c(OC)c(O)c2c3c(cc(C)c2c1)OC(C)(C)C(C=CC(C)=C)C3)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.585
InChIKey:WYDNDQRNUPHDCK-UHFFFAOYSA-N
ID: 98745
SMILES:C(=O)(C1CCC2c3c(O)cc(CCCCC)cc3OC(C12)C)C=C(C(O)=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -16.273
InChIKey:SUOVCEMWZOOZLL-UHFFFAOYSA-N
ID: 98746
SMILES:C1C(CO)(C)Oc2cc(CCCCC)cc(O)c2C1CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.647
InChIKey:HMDFCTOHQXFERZ-UHFFFAOYSA-N
ID: 98747
SMILES:C(=C)(C)C1C(c2c(O)cc(CCCCC)c(O)c2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 98748
SMILES:C(=CCCC(C)C)c1c2c(c3oc(CCCCC)c(C)c3c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -13.535
InChIKey:RTRQPLKOGVKCHD-UHFFFAOYSA-N
ID: 98749
SMILES:c1c(O)c(C)cc2c1C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.74
InChIKey:PBAKKBHBTISFBZ-UHFFFAOYSA-N
ID: 98750
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.444
CB1 binding score: -13.362
InChIKey:ADDQNWKYMWFECI-UHFFFAOYSA-N
ID: 98751
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1(O)C3(C2)C(CC(O)C(C)(C)O1)OC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.448
CB1 binding score: -15.331
InChIKey:FSGCVWRKGTYHRS-UHFFFAOYSA-N
ID: 98752
SMILES:C(CCCCCCc1cc2c(c(O)c1)C1C3C(CCC(O)C3OC2=O)(C)CCC1C(C)(C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -15.122
InChIKey:LPYGEFBJBNNNRK-UHFFFAOYSA-N
ID: 98753
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)(C(CCCC(C)=C)=C)O1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.755
InChIKey:XRQRJVLQOAIOER-UHFFFAOYSA-N
ID: 98754
SMILES:C1CC(C)=CC(c2c(O)c(C(=O)O)c(CCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.324
InChIKey:CZXWOKHVLNYAHI-UHFFFAOYSA-N
ID: 98755
SMILES:C1(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C(=O)OC)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.367
InChIKey:DJJGSXXHYLNCHK-UHFFFAOYSA-N
ID: 98756
SMILES:CC1=CC(c2c(CCCCC)cc(O)cc2OC)C(O)C2C(O)(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 374.521
CB1 binding score: -17.273
InChIKey:XSLFLXSYEMWNHK-UHFFFAOYSA-N
ID: 98757
SMILES:c1(C=O)c(O)c2c(cc1CCCCC)OC(C)(C)c1c-2c(O)c2c(c1)OC(C(O)(C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -12.403
InChIKey:WXMSCWUWQQOXKG-UHFFFAOYSA-N
ID: 98758
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCC)cc2O)C(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.822
InChIKey:ASRWRHVQAMKSRF-UHFFFAOYSA-N
ID: 98759
SMILES:C(C)C(C(C)(C)c1c(O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.428
InChIKey:JEVYRSXWIDIPOH-UHFFFAOYSA-N
ID: 98760
SMILES:C(Cc1c(O)c2c(c(C(CCCCCCC)C)c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.776
InChIKey:OLTZTGZZJXQRTI-UHFFFAOYSA-N
ID: 98761
SMILES:CC1CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 98762
SMILES:CC(O)(C)C1C(C)(C=C)CC(c2cc(CC=C(C)C)c(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.25
InChIKey:KQVXABLDFQXYRE-UHFFFAOYSA-N
ID: 98763
SMILES:C(CCc1cc(O)c(C2C(C(=C)C)CCC(C)C2)c(O)c1C=O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.974
InChIKey:ZISWGCFGABTFOV-UHFFFAOYSA-N