ID: 91666
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(=C)CCCC1(C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.195
InChIKey:GRKNBZFTYNMLIC-UHFFFAOYSA-N
ID: 91667
SMILES:C1c2c(O)cc(C)cc2OC(C)(C)C1CCC(C=C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.058
InChIKey:RTBVFVMFOGJQKL-UHFFFAOYSA-N
ID: 91668
SMILES:Oc1c(C(CC(C)O)O)c(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.693
InChIKey:WERMIDCTVDTRPD-UHFFFAOYSA-N
ID: 91669
SMILES:C1C(C)C=C2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 91670
SMILES:c1(O)c2c(cc(O)c1CC1C(C)(C)C=CCC1C)OC(C)(C)C1CC=C(C)CC1=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.879
InChIKey:AGQPIPKIJQFSAX-UHFFFAOYSA-N
ID: 91671
SMILES:O(C)Cc1cc2c(c(O)c1)C=CC(CCC=C(C)CCC1C(C)(C)O1)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.633
InChIKey:WMBYBUROEJHDTH-UHFFFAOYSA-N
ID: 91672
SMILES:C(C=C(C)C)CC(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 91673
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 91674
SMILES:C(CC(C)=CCCC1(C)Oc2c(O)c(O)cc(CCCCCC)c2C2CC1CC=C(C)C)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.749
CB1 binding score: -13.761
InChIKey:HRVVXVMHRXOMBV-UHFFFAOYSA-N
ID: 91675
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2(O)C1=C(C(=O)C)CC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.653
InChIKey:PZTYIIGBTVFUHN-UHFFFAOYSA-N
ID: 91676
SMILES:C1=C(CO)C(O)C2C(C1)C(C)(C)Oc1cc(CCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.502
InChIKey:JGKMRWHKBGMPNV-UHFFFAOYSA-N
ID: 91677
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)CC2)CC(C(C)=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.526
InChIKey:ADTVITHBSQAYBI-UHFFFAOYSA-N
ID: 91678
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 91679
SMILES:c1(CCCCC)ccc(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N
ID: 91680
SMILES:C12(C)C(C(C(C)C)CC1)C(=O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.052
InChIKey:CRSUNGZMPGFWFE-UHFFFAOYSA-N
ID: 91681
SMILES:Oc1c(C(O)=O)c(CCCCC)cc2c1C1C=C(C)CCC1(C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.592
InChIKey:RRKUIFXHUGBEBW-UHFFFAOYSA-N
ID: 91682
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 91683
SMILES:C(c1cc(C2C=C(C)CCC2C(C)=C)c(OC)cc1OC)(=O)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.904
InChIKey:FAIKXICUAZFVBV-UHFFFAOYSA-N
ID: 91684
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(O)(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 91685
SMILES:C(OC(CCC(c1c2c(c(O)cc1C)C1CC(CO)=CCC1C(C)(C)O2)=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.196
InChIKey:FLVZNMFDEXXUTB-UHFFFAOYSA-N
ID: 91686
SMILES:c1(O)cc2c(cc1OC)OC(C)(C)C1CC=C(CO)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.426
InChIKey:ABSKJBUIYWKPCO-UHFFFAOYSA-N