ID: 106996
SMILES:C(O)(CCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 318.413
CB1 binding score: -18.016
InChIKey:OVJKPQKAIHSVBC-UHFFFAOYSA-N
ID: 106997
SMILES:C12CC(O)C(C)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 106998
SMILES:c12cc(OC)cc(O)c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -19.386
InChIKey:BCARDKDANZSKCJ-UHFFFAOYSA-N
ID: 106999
SMILES:Cc1c(OC2OC(CO)C(O)C(O)C2O)c(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.5
CB1 binding score: -17.062
InChIKey:KDHLHOCRRKAWCM-UHFFFAOYSA-N
ID: 107000
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 107001
SMILES:C(CCC=C(C)C)(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 107002
SMILES:C(=C)(C1C(c2c(O)c(CC=C(C)C)cc(C)c2O)C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.728
InChIKey:PXKNUFFLGOHZLC-UHFFFAOYSA-N
ID: 107003
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(C(C)=C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.078
InChIKey:YZQTVMSDGCKDQL-UHFFFAOYSA-N
ID: 107004
SMILES:C(CCc1c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CCCC(C)=CC12)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.586
InChIKey:GPWHCIIHXOVPQH-UHFFFAOYSA-N
ID: 107005
SMILES:c1(CC=C(C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 107006
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 107007
SMILES:CC(C)(C1C(=C)C2c3c(c(O)cc(CCCCC)c3O)OC(C)(C)C2C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.349
InChIKey:KCRFVSOHISNYSW-UHFFFAOYSA-N
ID: 107008
SMILES:Oc1c(CC=C(CCC=C(C)C)C)cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N
ID: 107009
SMILES:OC1(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 107010
SMILES:c1c(O)c(CCCCC)cc2c1-c1cc3c(cc1CCC2=O)C1CC(O)C(C)(C)OC1(C)CC3CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.711
CB1 binding score: -15.293
InChIKey:POVNYPGMBCCYKD-UHFFFAOYSA-N
ID: 107011
SMILES:C1(C)(C)C2c3c(cc(CCCCC)cc3O)OC(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.585
InChIKey:BYBYJHZJKBPNNW-UHFFFAOYSA-N
ID: 107012
SMILES:c1(C2CC(C)=CC(c3c(O)cc(CCCCC)cc3OC)C2C(C)=C)c(O)c(C(=O)CC(C)C)c(O)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.719
CB1 binding score: -15.361
InChIKey:GBGGPMFJIXQXEF-UHFFFAOYSA-N
ID: 107013
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 107014
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)CC3C1(O)CC(C)C(=O)C32
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.753
InChIKey:AZFAQBQMELAMBH-UHFFFAOYSA-N
ID: 107015
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 107016
SMILES:C1CCC(C)(C)C1(C)CCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -15.451
InChIKey:IRYMSBXBDPDUFS-UHFFFAOYSA-N