ID: 129109
SMILES:O(C)c1cc(C)c(OC)c(OC)c1C1C(C)(C)OCC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.546
InChIKey:IMQWFXGXXLFQJM-UHFFFAOYSA-N
ID: 129110
SMILES:C12(OS(O)(=O)=O)C(C(C)(C)Oc3c1c(O)cc(C)c3)CCC(Br)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.363
CB1 binding score: -16.174
InChIKey:LBBLYRWBMZMERE-UHFFFAOYSA-N
ID: 129111
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 129112
SMILES:C1CC(C(CC(C)C)=O)=C(O)C(C)(C)C1Cc1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.688
CB1 binding score: -15.116
InChIKey:ZBXPAHZFFNGOSV-UHFFFAOYSA-N
ID: 129113
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CC=C(C)CCC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.813
InChIKey:LISQMXYEJUYUCR-UHFFFAOYSA-N
ID: 129114
SMILES:Oc1ccc(OC)c(C2C=C(C)CCC2C(=C)C)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.928
InChIKey:SWCYTGJBQQPCEM-UHFFFAOYSA-N
ID: 129115
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C)=CC(=O)C1(C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.706
InChIKey:XMDHRCUUPCCWTH-UHFFFAOYSA-N
ID: 129116
SMILES:c1c(OC)c(OC)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.672
InChIKey:RXIOJFHZIGQHTO-UHFFFAOYSA-N
ID: 129117
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 129118
SMILES:C(c1cc(O)c2c(c1)CC1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.526
InChIKey:FJGKTGXJLNFIEG-UHFFFAOYSA-N
ID: 129119
SMILES:c1c(O)c(C2C(C(C)=C)C(COC3C(O)C(O)C(O)C(CO)O3)C(C)CC2)c(O)cc1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.636
CB1 binding score: -13.851
InChIKey:SIVNBDGZYWNICC-UHFFFAOYSA-N
ID: 129120
SMILES:C12(C)CC1(c1c(O)ccc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.605
InChIKey:LNLXXZJOIMFJBI-UHFFFAOYSA-N
ID: 129121
SMILES:c12cc(C)c(OC)cc1C(=O)C1(O)C(C(C)(C)O2)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.198
InChIKey:VAYCDQPTBMZCFQ-UHFFFAOYSA-N
ID: 129122
SMILES:C(CCCCCCCCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.686
CB1 binding score: -15.706
InChIKey:WKDMPGFYUGDXJX-UHFFFAOYSA-N
ID: 129123
SMILES:C1(C)C(C)(c2cc(Br)c(C)cc2OC(=O)C)Oc2c(C(CC)C)c3c(cc21)OC(C)(C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 513.472
CB1 binding score: -16.499
InChIKey:PWKHILVBMWTFPJ-UHFFFAOYSA-N
ID: 129124
SMILES:C1(C2(C)OC2CC=C(C)C)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.431
InChIKey:FUQQGZZAXXNVDF-UHFFFAOYSA-N
ID: 129125
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 129126
SMILES:c1c(C)c2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.151
InChIKey:GDMFVEOFVVJWAQ-UHFFFAOYSA-N
ID: 129127
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 129128
SMILES:C1=C(C)C(=O)C(C=C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: Not available
InChIKey:VQINZAHTVUJJKT-UHFFFAOYSA-N
ID: 129129
SMILES:C(CC)Cc1cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -19.084
InChIKey:DOQHJUXXWKEFSQ-UHFFFAOYSA-N