ID: 113359
SMILES:COc1cc(CCCCC)cc2c1C1CC(C)(CC2)OC(C(C)(O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -17.42
InChIKey:WLHBEYKTNLJLRY-UHFFFAOYSA-N
ID: 113360
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 113361
SMILES:CCCCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 113362
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 113363
SMILES:C1(c2ccc(O)cc2)Oc2cc(CCCCC)cc(OC)c2C(C(CCC=C(C)C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.35
InChIKey:SLBVFDYERQSSPA-UHFFFAOYSA-N
ID: 113364
SMILES:c12c(O)cc(CCCCC)cc1OC1(C)CCC(O)C(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 332.484
CB1 binding score: -17.417
InChIKey:FZMURLFEULIFNG-UHFFFAOYSA-N
ID: 113365
SMILES:c1c(CCCCC)cc(O)c2c1OC1C(=C(C)C(=O)O1)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.609
InChIKey:JGLBEPIGFAGFDV-UHFFFAOYSA-N
ID: 113366
SMILES:Cc1c2c(c(OC)c(O)c1C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.12
InChIKey:ODAMCCRYENGRGU-UHFFFAOYSA-N
ID: 113367
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC1C2(C)CCCC1(C(=O)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -17.105
InChIKey:QLEHFTHYFJNSPB-UHFFFAOYSA-N
ID: 113368
SMILES:C(C=C)(C)(C=Cc1ccc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -16.94
InChIKey:QGPYRWUWNHMFLX-UHFFFAOYSA-N
ID: 113369
SMILES:Oc1c(CCCCC)cc2c(c1O)-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.286
InChIKey:NHNAENUOFBTILX-UHFFFAOYSA-N
ID: 113370
SMILES:Cc1ccc(C)c2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -17.359
InChIKey:VELAQXQZSXPGKC-UHFFFAOYSA-N
ID: 113371
SMILES:CC1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 113372
SMILES:C(C1(C)C(C(C)CCC=C(C)C)CCC(C)=CC1c1c(O)cc(CCC)cc1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -15.339
InChIKey:DORUYWNNSFYYOZ-UHFFFAOYSA-N
ID: 113373
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 113374
SMILES:c12c(cc(CCCCC)cc1OC)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -16.544
InChIKey:WRJURUVFVRSBTI-UHFFFAOYSA-N
ID: 113375
SMILES:c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 113376
SMILES:C(CCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.564
InChIKey:UZOOUOIKLIZZCO-UHFFFAOYSA-N
ID: 113377
SMILES:C1CC(C)(C)C(c2c(O)cc(CCCCC)cc2OC)CC1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.305
InChIKey:BCFPQXCKMMWMSZ-UHFFFAOYSA-N
ID: 113378
SMILES:C(=C(C=O)C)CCC1(C)Oc2cc(CCC(CC)C(C)C)cc(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.174
InChIKey:ZQDAVYFNCFNWRL-UHFFFAOYSA-N
ID: 113379
SMILES:O=C(O)C(C(CCC1(C)CC=C(CO)C(=O)C1c1c(O)cc(CCCCC)cc1O)=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.753
InChIKey:PAMFZTFFFAPSCG-UHFFFAOYSA-N