ID: 32509
SMILES:C12C(=CC(=O)C=C1)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.884
InChIKey:SDHQUIPRYCEHOO-UHFFFAOYSA-N
ID: 32510
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(=C)C3CC(C)(C)C(O)C3C(C(C)(O)CC1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.233
InChIKey:KKZMJMADLLQNGA-UHFFFAOYSA-N
ID: 32511
SMILES:C(CCCCCc1cc2c(c(O)c1)C1CC(CCC=C(C)C)=CCC1(C)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.669
CB1 binding score: -12.134
InChIKey:QVHDKYSLCUPOQS-UHFFFAOYSA-N
ID: 32512
SMILES:C(Cc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(CO)C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.6
InChIKey:BENUCSRPQOGJOM-UHFFFAOYSA-N
ID: 32513
SMILES:C12(Oc3c1c(OC)cc(CCCCCCC)c3)C(C)(O)CCC1C(C)(C)CCCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.095
InChIKey:ACQQMBLXWNOLIK-UHFFFAOYSA-N
ID: 32514
SMILES:C(CC(C)=C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 262.393
CB1 binding score: -18.21
InChIKey:CJIYDQZJDCAFIJ-UHFFFAOYSA-N
ID: 32515
SMILES:c1(O)ccc(CCc2cc(O)c(CC=C(CCC=C(CCC=C(C)C)C)C)c(O)c2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 32516
SMILES:CC(C)=CCOCC1=CCC2C(C)(C)Oc3c(c(OC(=O)C)ccc3O)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.938
InChIKey:APZUAHFXRLDRGS-UHFFFAOYSA-N
ID: 32517
SMILES:Oc1cc(CCCCC)cc2c1-c1c(cc3c(c1O)CCC(O)C3(C)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -12.716
InChIKey:HTPPTRCVNQTTER-UHFFFAOYSA-N
ID: 32518
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C(=O)OC(C)=O)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 402.531
CB1 binding score: -17.664
InChIKey:AYIRJXPFGGVROY-UHFFFAOYSA-N
ID: 32519
SMILES:OC12C(C1(C)C)C1c3c(O)cc(CCCCC)cc3OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.801
InChIKey:WKDHWWHCEATAEY-UHFFFAOYSA-N
ID: 32520
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 32521
SMILES:CC(C)=CC(=O)Oc1cc(CCCCC)cc(O)c1C1CC(CO)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -17.277
InChIKey:MQCSMSRZBUHPPL-UHFFFAOYSA-N
ID: 32522
SMILES:Oc1c2c(cc(C(C)(O)CCC=C(C)C)c1)OC(C)(C)C1CC=C(C)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.458
InChIKey:BFCFPAHBVFUTPM-UHFFFAOYSA-N
ID: 32523
SMILES:CC12Oc3c(c(OC)cc(CCCCC)c3)C(O)C1C1(C)CCCC(C(O)=O)(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -13.926
InChIKey:HVDPNIGZFFTLDD-UHFFFAOYSA-N
ID: 32524
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.141
InChIKey:BDFKQWLDHZHBNB-UHFFFAOYSA-N
ID: 32525
SMILES:O(C(=O)C(C(C)=O)O)c1c(O)c2c(cc1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -13.955
InChIKey:HIBSSGZPZNABNB-UHFFFAOYSA-N
ID: 32526
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1C2CC(C)(O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.323
InChIKey:MVZUXOTVKJKNMX-UHFFFAOYSA-N
ID: 32527
SMILES:c12c(O)cc(CCC)cc1OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.797
InChIKey:KERKCYZDMNZUKU-UHFFFAOYSA-N
ID: 32528
SMILES:c1c(C(CCC=C)CCC)c(O)c2c3c1OC(C)(C)C1CCC(C)(CC31)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.241
InChIKey:VOZVIMXSURNIAU-UHFFFAOYSA-N
ID: 32529
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.722
InChIKey:AYDXTCPHEBEVTJ-UHFFFAOYSA-N