ID: 56449
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 56450
SMILES:c1(O)c(CC=C(CCC=C(CCC=C(C)C)C)C)c(O)c(C(=O)O)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 56451
SMILES:c1(O)c2c(c(CCCC)cc1-c1c(CC)cc(O)c3c1C=CC(C)(C)O2)C1C(CCC(C)=C1)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.695
CB1 binding score: -13.936
InChIKey:MHKZXJZNHJVFFX-UHFFFAOYSA-N
ID: 56452
SMILES:c1(CCCCC)ccc(C2C=C(C)CC(c3cc(CCN(C)C)ccc3OC)C2C(C)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 459.718
CB1 binding score: -13.991
InChIKey:JLSUXXKUCWPQFT-UHFFFAOYSA-N
ID: 56453
SMILES:O1C(C)(C)C2C(c3c(OC)c4c(cc3O2)C=CC(C)(CCC=C(C)C)O4)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.078
InChIKey:PPEWVRWUTYHXHO-UHFFFAOYSA-N
ID: 56454
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2)C(C(C)=C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.134
InChIKey:DPFBZCKVANCGBY-UHFFFAOYSA-N
ID: 56455
SMILES:CC(=CCCC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 56456
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(=C)C)C(C=C1C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.425
InChIKey:QXYDLUSOPCNFKI-UHFFFAOYSA-N
ID: 56457
SMILES:C(CCC)Cc1cc(O)c(C2C(C(C)(C)O)CC(O)C3(C)Oc4cc(O)c(O)cc4CC32)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -14.201
InChIKey:KPTUOYZJGCOIQD-UHFFFAOYSA-N
ID: 56458
SMILES:CC1(C)CCC(Cc2c(O)c(O)cc(CCCCC)c2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -16.335
InChIKey:CLVYQQUVVGBTOQ-UHFFFAOYSA-N
ID: 56459
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(=C)C1C2(C)C(O)(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -13.749
InChIKey:DRLGUUSBZCSWOB-UHFFFAOYSA-N
ID: 56460
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 56461
SMILES:C12C3(C(=O)C(C)C1C)c1c(O)cc(CCCCC)cc1OC3(C)CCC2=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -13.648
InChIKey:LPZSITQFIZCRMF-UHFFFAOYSA-N
ID: 56462
SMILES:C(C(OC(C)=O)Oc1c(CCC(O)=O)cc(O)c(C2C(C(O)(C)C)CCC(C)=C2)c1O)=CC(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.592
CB1 binding score: -15.733
InChIKey:FFAHATGRKGETKZ-UHFFFAOYSA-N
ID: 56463
SMILES:c1(OC)c(OC)c(Cl)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.832
CB1 binding score: -17.068
InChIKey:XTFUYGHKLGEWOY-UHFFFAOYSA-N
ID: 56464
SMILES:C1(C)(C=C)C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC1CCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -13.568
InChIKey:GOGWBRRYKSMNJR-UHFFFAOYSA-N
ID: 56465
SMILES:c1(CC=C(C)CCC=C(C)C)cc(O)c(CCC(O)=O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.28
InChIKey:SGHLDWXNFNXDJR-UHFFFAOYSA-N
ID: 56466
SMILES:C1C2C(C)(C)Oc3c(c(O)c(C(C)CCCCC)cc3O)C3C2(C)C1CC3O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.216
InChIKey:JOILPOORCCODRW-UHFFFAOYSA-N
ID: 56467
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 56468
SMILES:CC1=CC(c2c(O)cc(CCCCCO)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.184
InChIKey:ZKGKOAJUWMGRFB-UHFFFAOYSA-N
ID: 56469
SMILES:c1c(CCCC=CC)c(O)c2c3c1OC(C)(C)C1CCC(C)(C21)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.502
InChIKey:NRHIFGIKGTXFGI-UHFFFAOYSA-N