ID: 42043
SMILES:Oc1c(O)c(CC=C(C)C)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.929
InChIKey:AMCFAMJMTHAAIB-UHFFFAOYSA-N
ID: 42044
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(c(C(=O)O)c(O)cc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.371
InChIKey:FWFDIRSMLQOZQS-UHFFFAOYSA-N
ID: 42045
SMILES:O1C2C(O)(C)CCC(=O)C3(c4c(cc(CCCCC)cc4O)OC13)OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -13.012
InChIKey:OVDGUHIXSGJTIY-UHFFFAOYSA-N
ID: 42046
SMILES:C(CC)C(O)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.766
InChIKey:AELPELOAXYOPMS-UHFFFAOYSA-N
ID: 42047
SMILES:c12c(ccc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.987
InChIKey:RMWYCANPNUTKIT-UHFFFAOYSA-N
ID: 42048
SMILES:C1=C(C)CCC2C(CO)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.688
InChIKey:KSBFJCNCRBZZJR-UHFFFAOYSA-N
ID: 42049
SMILES:c1(O)cc(C(C)(C)C)cc(CC=C(C)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.833
InChIKey:UHAYOYZMTRITRG-UHFFFAOYSA-N
ID: 42050
SMILES:Cc1cc(O)c2c(c1)C(=O)C(O)(CC(Cl)C(=C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.961
CB1 binding score: -10.819
InChIKey:MCGIPEPIHDDHFP-UHFFFAOYSA-N
ID: 42051
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 220.312
CB1 binding score: -17.772
InChIKey:YVGFJIKWCMZZAS-UHFFFAOYSA-N
ID: 42052
SMILES:Oc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 42053
SMILES:CC1=CC(c2c(O)cc(CCCCC)c(O)c2)C(C(COC(=O)C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.849
InChIKey:MBYOHRBDWAARAA-UHFFFAOYSA-N
ID: 42054
SMILES:C1c2c(c(C(C)C)ccc2C)Oc2c(c(O)cc(CCCCC)c2)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.61
CB1 binding score: -15.248
InChIKey:CQBNXIGDDCKSAV-UHFFFAOYSA-N
ID: 42055
SMILES:Oc1cc(CCCCC)c(C(=O)O)c(O)c1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 42056
SMILES:C12C(CC(C)=C(C)C(=O)C1C)Oc1c(c(O)cc(CCCCC)c1)C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.568
InChIKey:RQAMMHFOEIOJOM-UHFFFAOYSA-N
ID: 42057
SMILES:C12(CC=C(C(=O)O)CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.929
InChIKey:CPTUWGZXKDIHIK-UHFFFAOYSA-N
ID: 42058
SMILES:Oc1c(C(=O)C(CC)C)c2c(cc1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.434
InChIKey:GATXJHCPXUEHHZ-UHFFFAOYSA-N
ID: 42059
SMILES:C(O)[N+](C)(C)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.464
CB1 binding score: -16.44
InChIKey:NIEYCPVSRZYFQW-UHFFFAOYSA-O
ID: 42060
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 42061
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 42062
SMILES:C12(O)C(c3c(cc(CCCCC)cc3O)OC1(C)C)C(=O)C1=C(OC3(C)OCCC3C1=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.535
CB1 binding score: -15.401
InChIKey:WPMOUEPIGYCDMC-UHFFFAOYSA-N
ID: 42063
SMILES:OC1(C(=C)C)CCC2(C)CCCC(O)(C)C2C1c1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -15.82
InChIKey:JPFXDPVTAWCJLC-UHFFFAOYSA-N