ID: 68755
SMILES:C(CC(c1cc(C(=O)O)c(O)c(C2C(C(C)=C)CCC(C)=C2)c1O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -14.269
InChIKey:KCIIBZDMLZUTJK-UHFFFAOYSA-N
ID: 68756
SMILES:O1c2c(c(O)cc(CCC)c2)C2C(C1(CCC=C(CO)C)COC(=O)C)C(=O)C(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -17.021
InChIKey:JESJRKLESKIHQF-UHFFFAOYSA-N
ID: 68757
SMILES:C1(C)=CC=CC2C3(C)C(C(O)CC12C)c1c(O)cc(CCCCC)cc1O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.55
InChIKey:UPZPKIIRVINLRD-UHFFFAOYSA-N
ID: 68758
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 68759
SMILES:c1(CCCCC)c(O)cc2c(c1C(OC)=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.33
InChIKey:LZBUQWYGJCXAIA-UHFFFAOYSA-N
ID: 68760
SMILES:O=C(c1c(O)cc(CCCCC)cc1O)C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.768
InChIKey:NXXHMSMYWFOUJV-UHFFFAOYSA-N
ID: 68761
SMILES:O=C(O)CCCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.998
InChIKey:PDVFZZOZSVUPFE-UHFFFAOYSA-N
ID: 68762
SMILES:Oc1cc(CCCCC)c(O)c2c1OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.266
InChIKey:GEEMMNOKGSQDQI-UHFFFAOYSA-N
ID: 68763
SMILES:C1(CO)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 68764
SMILES:O1C(COC2C(O)C(O)C(OC(=O)C)CO2)C(O)C(O)C(O)C1Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 650.762
CB1 binding score: -15.497
InChIKey:BNSYIDHYQNFZHT-UHFFFAOYSA-N
ID: 68765
SMILES:Cc1cc(=O)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -15.62
InChIKey:KVKVLWVHNAJWJH-UHFFFAOYSA-N
ID: 68766
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.752
InChIKey:VYIZICNYGOLKOY-UHFFFAOYSA-N
ID: 68767
SMILES:CC1(CCC2(C)C(=O)C3C2c2c(O)cc(CCCCCN=C)cc2O3)CCC(=O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.596
CB1 binding score: -15.103
InChIKey:NEAQZSFYRVELTC-UHFFFAOYSA-N
ID: 68768
SMILES:c1(O)c2c(cc(C(O)=O)c1CCCCCC)OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: Not available
InChIKey:PABIUPUXRGMBNJ-UHFFFAOYSA-N
ID: 68769
SMILES:CC1(C)C2c3c(cc(C)cc3O)OC3(C)C2CC1OC3=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -14.651
InChIKey:VTTAHIOBFHEVMF-UHFFFAOYSA-N
ID: 68770
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)=C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 68771
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 68772
SMILES:c1(O)c(C(=O)C(C)C)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 68773
SMILES:C(=C(C)C(=O)c1c(O)c2c(O)c(C3C(C(C)=C)CCC(C)=C3)cc(CCC(O)C(C)=C)c2OC(C)(C)C1CC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 588.829
CB1 binding score: -11.988
InChIKey:HWPOJJSWZVBFRW-UHFFFAOYSA-N
ID: 68774
SMILES:Oc1cc(CCCC)c(OC)c(CC=C(CCC=C(C)C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.039
InChIKey:HKLWKHBWKKBTJB-UHFFFAOYSA-N
ID: 68775
SMILES:C(OC)(=O)Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.467
InChIKey:XCQQSCVQPKOJDE-UHFFFAOYSA-N