ID: 122053
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 122054
SMILES:C1c2cc(Cl)c(OC)cc2C(=O)C2=C1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.865
CB1 binding score: -13.908
InChIKey:RQWPLQDGRLMFIF-UHFFFAOYSA-N
ID: 122055
SMILES:c1(O)c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 122056
SMILES:C(Cc1c(OC)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1C(O)=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.033
InChIKey:DHJQORLURYPUEC-UHFFFAOYSA-N
ID: 122057
SMILES:C1C(Oc2c(CC=C(CCC=C(C)CCC=C(C)C)C)c(O)cc(O)c2)=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -17.527
InChIKey:GBVKQXNLFXXQHJ-UHFFFAOYSA-N
ID: 122058
SMILES:c1(C(CC(=O)NCCS(C)(C)=O)C2=CCCC(C)(O)C2(C)C)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 559.813
CB1 binding score: -15.848
InChIKey:GICCNPKMRCDECB-UHFFFAOYSA-N
ID: 122059
SMILES:C(C=C(C)C)CC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 122060
SMILES:c1(CC=C(C)CCC23C(C)(O2)CCC(C)C3(O)C)c(OC(C)=O)cc(C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.596
InChIKey:HKKVFCKTLXCUJG-UHFFFAOYSA-N
ID: 122061
SMILES:C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 122062
SMILES:Oc1cc(CC=C(CCC2(C)C(C)Cc3c(O)ccc(O)c3C2=O)C)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -14.587
InChIKey:UPBXPXYUXANYCM-UHFFFAOYSA-N
ID: 122063
SMILES:C12=CCC3C(C)(C)Oc4c(ccc(C(C)=O)c4C)C3C1(C)CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.502
CB1 binding score: -10.99
InChIKey:AERDEOSXUNNTTJ-UHFFFAOYSA-N
ID: 122064
SMILES:c1c(O)c(C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 122065
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 122066
SMILES:C(C=C(C)C)(c1c(O)cc(CCCCC)cc1OC)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.021
InChIKey:MYNVJTJCLPVZAY-UHFFFAOYSA-N
ID: 122067
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCC)cc1O)(C)(CCC=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.437
InChIKey:MTOGTVKJXDHJSU-UHFFFAOYSA-N
ID: 122068
SMILES:Oc1c(CC=C(C)CCC=C(C)CCC(O)=O)c(O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.737
InChIKey:PSIRWNVZSKDPKP-UHFFFAOYSA-N
ID: 122069
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CCC(COC(c3ccccc3)=O)(O)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.859
InChIKey:JCJAVQNKXKEREW-UHFFFAOYSA-N
ID: 122070
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC(CCCC(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -12.86
InChIKey:GRGMMAVCLFRSFR-UHFFFAOYSA-N
ID: 122071
SMILES:c1c(O)cc2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N
ID: 122072
SMILES:C1(C)C2C(C)(C)Oc3cc(C)cc(O)c3C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.673
InChIKey:LVWBNEPMSAQCAG-UHFFFAOYSA-N
ID: 122073
SMILES:C(CC=C(C)C)C1(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.758
InChIKey:BBSLEQVLKFGGIE-UHFFFAOYSA-N