ID: 67705
SMILES:CC1C=C2C(C)(C)Oc3c(c(O)cc(CCC)c3CCCCC)C2CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -11.791
InChIKey:AMECDYIKPPWAQF-UHFFFAOYSA-N
ID: 67706
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 67707
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3(C)C(C(C)(CCCC(C)C)CCC3)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.712
CB1 binding score: -13.546
InChIKey:TZNVPXDPTSLDTG-UHFFFAOYSA-N
ID: 67708
SMILES:C(Cc1cc(OC)c(O)c(C2C=C(C)CCC2C(=C)C)c1)#C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -14.966
InChIKey:GAPLPFNKLYTTND-UHFFFAOYSA-N
ID: 67709
SMILES:C(=CCC(=CCc1c(O)cc(CCC)c(C(=O)O)c1O)C)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 386.532
CB1 binding score: -14.242
InChIKey:TXDWOYMXUHYFCC-UHFFFAOYSA-N
ID: 67710
SMILES:c1(C2C(C(=C)C)C(c3c(OC)ccc(CCN(C)C)c3)CC(C)=C2)ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.583
CB1 binding score: -16.249
InChIKey:DREAUBDJYUVJLP-UHFFFAOYSA-N
ID: 67711
SMILES:C(CCCC)c1cc(O)c(C2C=C(C(O)=O)CCC2C(C)(O)CCC=C(C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.54
InChIKey:NDJXDCJEBMBITP-UHFFFAOYSA-N
ID: 67712
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCCC)c2)C2C3=CC4C(C)(C)C3C4(C)CC(O)C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -15.971
InChIKey:IDZXDNIJLQOCAG-UHFFFAOYSA-N
ID: 67713
SMILES:CC(C)C1C(c2c(O)cc(CCCC[N+](C)(C)C)cc2O)CC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.545
CB1 binding score: -15.894
InChIKey:LPJXKXPAWXKQJS-UHFFFAOYSA-O
ID: 67714
SMILES:c1(O)c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 67715
SMILES:C(CCO)c1c(C2C(C(C)=C)CCC(C)=C2)c(O)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.552
InChIKey:HUTFKJUUPPHZIZ-UHFFFAOYSA-N
ID: 67716
SMILES:Oc1c(O)c2c(c(CCl)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.805
CB1 binding score: -16.161
InChIKey:FUCBKCVNPMLPPV-UHFFFAOYSA-N
ID: 67717
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C=C(C=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.687
InChIKey:WUKPITZIDDNGJC-UHFFFAOYSA-N
ID: 67718
SMILES:C1(C2(C)C(=C)C3CCC2(C)O3)(COC)Oc2cc(CCCCC)cc(O)c2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.442
InChIKey:JLJCKAFQARBUFV-UHFFFAOYSA-N
ID: 67719
SMILES:C(CC)(c1cc2c(c(O)c1)C1C(C(C)(O)CCC1C(C)(C)O)CCC(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 404.591
CB1 binding score: -14.636
InChIKey:VBIHVNVEQHSOSW-UHFFFAOYSA-N
ID: 67720
SMILES:C=C(C1c2c(cc(O)c(C)c2)-c2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -15.12
InChIKey:HDQDWAZJXIJBNE-UHFFFAOYSA-N
ID: 67721
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 67722
SMILES:c12c(O)cc(CCCCC)c(C(O)=O)c1CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -16.085
InChIKey:WWPQRQJSTOYLAG-UHFFFAOYSA-N
ID: 67723
SMILES:c12c(O)cc(C)cc1OC(C)(C)C(=O)CC2C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -15.797
InChIKey:DKJLMTNZHJJCKV-UHFFFAOYSA-N
ID: 67724
SMILES:C(CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)OC2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.186
InChIKey:IDWHIXGZUMEDTH-UHFFFAOYSA-N
ID: 67725
SMILES:C1=C(C)CCC2C(CO)(C)Oc3c(c(OC)cc(O)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -13.979
InChIKey:LYQTVJHGMWEIFU-UHFFFAOYSA-N