ID: 38662
SMILES:C(O)(C1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -18.209
InChIKey:RAWHNNKBKXBZJY-UHFFFAOYSA-N
ID: 38663
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 38664
SMILES:C(C)(C)C1=CCC2(C)C(OC)C1c1c(cc(CCCCC)c(C(OC)=O)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.749
InChIKey:IXOGMGGTXIJJRO-UHFFFAOYSA-N
ID: 38665
SMILES:C1CC2(C)Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C2C(O)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.67
InChIKey:ITTDZDCFQRYIFA-UHFFFAOYSA-N
ID: 38666
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 38667
SMILES:Oc1cc(C(C(O)C(C)CC)O)c(O)c2c1OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.481
CB1 binding score: -14.185
InChIKey:DPUUMWAGSHLZQP-UHFFFAOYSA-N
ID: 38668
SMILES:C1CC23C(=O)OC(C1C(C)(C)Oc1cc(C)cc(O)c12)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -11.86
InChIKey:GZYKTGRAZTYAFR-UHFFFAOYSA-N
ID: 38669
SMILES:C1C(C)=CC(c2cc(CCNC)ccc2CO)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.458
CB1 binding score: -13.08
InChIKey:FFRFWFDYHOJKRR-UHFFFAOYSA-N
ID: 38670
SMILES:c1(C)c(OC)c(OC)c2c(c1)C(=O)C1(OC)C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.842
InChIKey:BDAPWXASYMGOLA-UHFFFAOYSA-N
ID: 38671
SMILES:O(C(C)=O)C1C=C(C)C(OC(=O)C=Cc2ccccc2)CC=C(C)CCC2C(C)(C)Oc3cc(CCC)cc(c32)OC(C)(C)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 630.822
CB1 binding score: -13.907
InChIKey:VASOABIXPLYZEA-UHFFFAOYSA-N
ID: 38672
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 38673
SMILES:CCCCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 38674
SMILES:C1(C)CCC2C(C)(C)Oc3c(c(O)cc(CO)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.796
InChIKey:XAGPVCMEKIDKRZ-UHFFFAOYSA-N
ID: 38675
SMILES:C12(C)C(C(=O)CC3(C)C(C(Cc4c(O)c(C)cc(OC)c4)(C)CCCC=C(C)CO)CCC13)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -16.246
InChIKey:XFSWIHHSDPPXHJ-UHFFFAOYSA-N
ID: 38676
SMILES:OCC(C)(C(O)Cc1cc(O)c(CC=C(C)CCC=C(C)C)cc1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.807
InChIKey:JUSZHMPJOIXYIW-UHFFFAOYSA-N
ID: 38677
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1c2c(O)cc(CCC=CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.541
InChIKey:KHKXVDQJIVCIDB-UHFFFAOYSA-N
ID: 38678
SMILES:C1(C)=CCC2C(C1O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 38679
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)(C)C2CCC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -11.802
InChIKey:IIQMXGOGVRYVHC-UHFFFAOYSA-N
ID: 38680
SMILES:C1(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2)C(C)(C)C(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -13.674
InChIKey:XHTVMPWKBGNMEI-UHFFFAOYSA-N
ID: 38681
SMILES:c1(C2(C(O)=O)OC(CO)C(C(O)=O)C2C(OC)=O)c(C=C(C)C)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.511
CB1 binding score: -13.78
InChIKey:SURDPMHFIXBLSC-UHFFFAOYSA-N
ID: 38682
SMILES:[N+](=O)(O)c1ccc(OC)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.367
CB1 binding score: -15.69
InChIKey:KRANAQWZUIFQML-UHFFFAOYSA-N