ID: 84568
SMILES:c12c(c(O)cc(CCCCC)c1)C1CC(=C)CCC1C(C)(O)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.62
InChIKey:UXZUPRACRIKARX-UHFFFAOYSA-N
ID: 84569
SMILES:C1(C)(C)CCCC(C)=C1C(=O)C1C(C)=CC(c2c(O)cc(CCCCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.421
InChIKey:KREIELIQRBNNQM-UHFFFAOYSA-N
ID: 84570
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC1C(C)(O2)C=CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.533
InChIKey:LLGJANNPYMQHGS-UHFFFAOYSA-N
ID: 84571
SMILES:C(CCCC)c1cc(O)c2c(c1)C1CC(C=CC=C(C)C)(C)OC1(O)C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -17.527
InChIKey:YCCXDVCCIUMVSA-UHFFFAOYSA-N
ID: 84572
SMILES:O1c2c(c(OC)cc(CCCCC)c2)C2CCC(C)=CCCC(C)=CCC1(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -14.858
InChIKey:ROPRJDFTVDMOCO-UHFFFAOYSA-N
ID: 84573
SMILES:CC(C)=CCCC(=C)CC(c1c(O)c(C(=O)O)c(CCCCC)cc1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.22
InChIKey:VDRAONJCAYQVGU-UHFFFAOYSA-N
ID: 84574
SMILES:CC(C)=CCCC(C)=CCCC1(C)C=Cc2c(O)cc(CCCCC)c(C(=O)OC)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.047
InChIKey:XDZVFYGISRPGPY-UHFFFAOYSA-N
ID: 84575
SMILES:C1=C(OC)C(=O)c2c(cc(CCCCC)cc2O)OC1C(CCC=C(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.285
InChIKey:SJIXFQSIBPNCSG-UHFFFAOYSA-N
ID: 84576
SMILES:COC1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.888
InChIKey:PUAYZKBVSPXFKX-UHFFFAOYSA-N
ID: 84577
SMILES:O=C(C)Oc1cc2c(cc1)C(C)(CCC(O)=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.432
InChIKey:RQCYGHSPYALJLS-UHFFFAOYSA-N
ID: 84578
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 84579
SMILES:C1C2C(C)(C)Oc3c(ccc(C)c3)C2C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 84580
SMILES:c1(=O)ccc(CCCCC)cc2c1OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.658
InChIKey:GURAKESQYRQPJM-UHFFFAOYSA-N
ID: 84581
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C(OC)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 84582
SMILES:C1=C2C(=O)c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.036
InChIKey:QBWDUIINRSBMOM-UHFFFAOYSA-N
ID: 84583
SMILES:C(C)(C)C(=O)c1c(O)c2c(cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.334
InChIKey:DANOCMQSDCIDGQ-UHFFFAOYSA-N
ID: 84584
SMILES:C(C)(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 84585
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 84586
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -20.991
InChIKey:VUUOQMIMZAXLBK-UHFFFAOYSA-N
ID: 84587
SMILES:C1(C)(CCC=C(C)CCC=C(C)C)C2CC3C(CO)(C2C1)Oc1c(C(OC)=O)c(CCCCC)cc(O)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.742
CB1 binding score: -15.521
InChIKey:JBEFCGRGWDUZII-UHFFFAOYSA-N
ID: 84588
SMILES:CC(C)=CCc1c(O)c(C)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -17.838
InChIKey:GWDOHXRUIIZWCK-UHFFFAOYSA-N