ID: 75496
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 75497
SMILES:C(C)(C)=CC(=O)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -11.819
InChIKey:RSOWYRHSLNYBAW-UHFFFAOYSA-N
ID: 75498
SMILES:C(Cc1cc(O)c2c(c1)OC(c1ccccc1)(C(C)C)C2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -16.776
InChIKey:XIGLSIXALXFGNS-UHFFFAOYSA-N
ID: 75499
SMILES:C12(C(=O)O1)CCC(C)=CC2c1c(CCCCC)cc(O)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.1
InChIKey:WOSSRKPELIKSNL-UHFFFAOYSA-N
ID: 75500
SMILES:C(CCCC)Cc1cc2c(c(O)c1C=O)C1C(C)(O2)CCC2C(C)(C)C3CC(C)C(CC12)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.317
InChIKey:XFZKRKIWPRPOHM-UHFFFAOYSA-N
ID: 75501
SMILES:CC1(C)Oc2c(c(O)cc(CCC(=O)C)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.64
InChIKey:NLNTYNQQFDNDTM-UHFFFAOYSA-N
ID: 75502
SMILES:Oc1c(C(C(C)CC)=O)c2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -15.302
InChIKey:YAKJLHSWDULQQD-UHFFFAOYSA-N
ID: 75503
SMILES:C(CC=C(C)C)C1(C)C=Cc2c(O)c(C(=O)O)cc(CCCCC)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.057
InChIKey:XTECEPJLXBGVGL-UHFFFAOYSA-N
ID: 75504
SMILES:c1c2c(cc(CCCCCC)c1)OC(C)(C)C1CCC(C)=CC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.154
InChIKey:YSHQXFYIEJQGFC-UHFFFAOYSA-N
ID: 75505
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C(=O)O2)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.548
CB1 binding score: -14.776
InChIKey:PJNLYSAQHLQTDM-UHFFFAOYSA-N
ID: 75506
SMILES:C1(C)=C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.334
InChIKey:GCJWCDVNTXLVOB-UHFFFAOYSA-N
ID: 75507
SMILES:C(CCc1c2c(c(O)c(C(CC(C)C)=O)c1O)OC(C)(C)C1C2C=C(C)CC1)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.39
InChIKey:OHIQGTGJKUAMOV-UHFFFAOYSA-N
ID: 75508
SMILES:CC1(C)C2C(c3c(cc(C)cc3O)OC1)C(CO)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.169
InChIKey:DCNUGAAEXSFMAR-UHFFFAOYSA-N
ID: 75509
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C=O)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -13.667
InChIKey:OXBBKWMOCGZBEB-UHFFFAOYSA-N
ID: 75510
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 75511
SMILES:C1=CC(C)(CCC=C(C)CCC=C(C)C)Oc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -18.505
InChIKey:HDFDVFHITGCJEG-UHFFFAOYSA-N
ID: 75512
SMILES:C(CCc1cc(O)c2c(c1C)OC(C)(C)C1C2CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -14.672
InChIKey:PAXNSSGXBGQUEE-UHFFFAOYSA-N
ID: 75513
SMILES:C1C(C)=CC(c2c(O)cccc2)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 75514
SMILES:C1(O)Oc2c(c(CCC(=O)OCC)c(O)cc2CCCCC)C2C(C(CCC=C(C)C)(C)O)CCC12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.719
CB1 binding score: Not available
InChIKey:NVTCWSULXZNAFR-UHFFFAOYSA-N
ID: 75515
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.365
InChIKey:WVOLTBSCXRRQFR-UHFFFAOYSA-N
ID: 75516
SMILES:Cc1cc(Oc2cc(CCCC)ccc2O)c2c(c1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -14.241
InChIKey:UJXBBFAFFIPYLQ-UHFFFAOYSA-N