ID: 128563
SMILES:C1C(C)=CC(c2c(CCCCC)cc(C(=O)O)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.991
InChIKey:NPMYQIGZAABKIC-UHFFFAOYSA-N
ID: 128564
SMILES:C1=C2C(CC(C)(C)C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.735
InChIKey:RABWPLVTCBSWGQ-UHFFFAOYSA-N
ID: 128565
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2C(=C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.83
InChIKey:PUWDMOICCGQQFH-UHFFFAOYSA-N
ID: 128566
SMILES:CCCc1ccc(O)c2c1OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.001
InChIKey:RIJPOBWSGHDJJK-UHFFFAOYSA-N
ID: 128567
SMILES:c1c(C(=O)c2ccccc2)c(O)cc(C2C=C(C)CCC2C(=C)C)c1OC(C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -14.69
InChIKey:DLSCZSXDAIOMLN-UHFFFAOYSA-N
ID: 128568
SMILES:C(CC(C)=CCc1c(O)c(C)cc(O)c1)CC(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.162
InChIKey:GVVUQQWWMGBFAL-UHFFFAOYSA-N
ID: 128569
SMILES:C1(C)(O)CCC2C(C)(C)Oc3c(c(O)c(C(CCC)=O)cc3O)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.034
InChIKey:SYFYZFGLHMGQMO-UHFFFAOYSA-N
ID: 128570
SMILES:O=C(OCC1(C)C2C1c1c(O)cc(CCCCC)cc1OC2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.253
InChIKey:MCPUSCRSPSOVGU-UHFFFAOYSA-N
ID: 128571
SMILES:OC1C(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2OC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -14.239
InChIKey:CFZYDCXKTXSUSQ-UHFFFAOYSA-N
ID: 128572
SMILES:CC(C)=CCc1cc2c(c(O)c1C=O)C1C=C(C)C(O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 356.462
CB1 binding score: -13.451
InChIKey:GFBPOSOYEUUCJV-UHFFFAOYSA-N
ID: 128573
SMILES:C1=CC(C)(C)Oc2c(c(CCCCC)cc3c2OC2(C)CC(O)C3C(C)(C)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.802
InChIKey:IWUKFDODGYTXCR-UHFFFAOYSA-N
ID: 128574
SMILES:C1(C)(C)CC(CC(=CCCC(=CCc2cc(O)cc(C)c2O)C)O)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.374
InChIKey:BMPKSHZZGBXXDZ-UHFFFAOYSA-N
ID: 128575
SMILES:C(CCCCCCCCCc1cc(OC(=O)C)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.722
CB1 binding score: -16.043
InChIKey:SKPZYNGLXCILKW-UHFFFAOYSA-N
ID: 128576
SMILES:CC1(C)Oc2cc(CCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 128577
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(C(C)C)CC1C(C)(O)CCC1C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 386.576
CB1 binding score: -14.45
InChIKey:JQPZGDMQACDVHI-UHFFFAOYSA-N
ID: 128578
SMILES:C1=CC2(C(=O)C)C(=O)OC(C)(CC(O)C(C(C)=C)C(CC(C)=CCc3c(O)cc(C)cc3O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.589
CB1 binding score: -18.233
InChIKey:BOYWJYNTJBIBNH-UHFFFAOYSA-N
ID: 128579
SMILES:c1(CC=C(CO)CCC=C(C)C)c(O)c2c(cc1C)Oc1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -13.698
InChIKey:DGWMZBNWWLYAJD-UHFFFAOYSA-N
ID: 128580
SMILES:O(C1(CC=C(C)C)Oc2c(cc(CCCCC)cc2OC)C1C)C(OC)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: Not available
InChIKey:AXCUPWPGJDPPIO-UHFFFAOYSA-N
ID: 128581
SMILES:C(c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.847
InChIKey:LTNFKKLHMWRKIW-UHFFFAOYSA-N
ID: 128582
SMILES:Oc1c(CC=C(CCC=C(C)CCC=C(C)C)C=O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.959
InChIKey:BNFHWQFPCFKLJB-UHFFFAOYSA-N
ID: 128583
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)c(O)ccc1C(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -18.079
InChIKey:AYVVBMDDEODWMD-UHFFFAOYSA-N