ID: 45550
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)ccc3C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.546
InChIKey:GHASULVAOGUFNM-UHFFFAOYSA-N
ID: 45551
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45552
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2c3c(cc(O)c(O)c3CO)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -15.571
InChIKey:HDAHYIJRSSCOBQ-UHFFFAOYSA-N
ID: 45553
SMILES:Nc1c(C2C=C(C)CCC2C(=C)C)c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 243.35
CB1 binding score: -16.217
InChIKey:IOULXLJCPFQCOP-UHFFFAOYSA-N
ID: 45554
SMILES:C(C#C)=C(C1CC(C(C)=C)CCC1(C)C(=O)C)c1cc(CCCC)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -13.716
InChIKey:AQUKYVQONDKPDZ-UHFFFAOYSA-N
ID: 45555
SMILES:CC(C)=CCCC1(C)Oc2c(O)c(O)cc(CCCCC)c2C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.693
InChIKey:JHMIUJWRWWEGFR-UHFFFAOYSA-N
ID: 45556
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.912
InChIKey:JKUWZILTAIFPQY-UHFFFAOYSA-N
ID: 45557
SMILES:C=C(C)C1CCC(C)=CC1c1c(C)cc(O)c(C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.157
InChIKey:XXVNWTWDNMJBII-UHFFFAOYSA-N
ID: 45558
SMILES:O1C2c3c(cc(CCCCC)cc3OC3(C)C=CC(C(C)C)CC3)CC12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -17.239
InChIKey:QIQKHTIIESWDGC-UHFFFAOYSA-N
ID: 45559
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=CC=C(C)CC12)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.438
InChIKey:JLAYRMBTMGXRBE-UHFFFAOYSA-N
ID: 45560
SMILES:c1(C=O)cc(CCCCC)cc2c1OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.69
InChIKey:FHXPIBNYVSCOEX-UHFFFAOYSA-N
ID: 45561
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(O)(C)CCCC(C)C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.645
CB1 binding score: -14.843
InChIKey:JAIFBPGAZRURNV-UHFFFAOYSA-N
ID: 45562
SMILES:c1c(C(C)O)cc(O)c2c1OC1(C)C3CC(C)(C)CC31O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -12.284
InChIKey:KGAODOULRXDJPK-UHFFFAOYSA-N
ID: 45563
SMILES:CC12C(c3c(O)cc(CCCCC)cc3O1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.015
InChIKey:QGZDKKOEHBWEOG-UHFFFAOYSA-N
ID: 45564
SMILES:C(C)(C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 45565
SMILES:C1=C(C)CC(O)C2C(C)(C)Oc3ccc(O)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.277
InChIKey:GQGFNTIDIOATQF-UHFFFAOYSA-N
ID: 45566
SMILES:C1(C(C)C)C(c2c(O)cc(CCC(=O)C(=C)C)cc2)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.438
InChIKey:QDSNEGGWDJOWJX-UHFFFAOYSA-N
ID: 45567
SMILES:C1(=O)Oc2c(c(O)cc(CCCCC)c2)C2OC(CCC1(O)C)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -14.744
InChIKey:NMRUVFVZMUJDQF-UHFFFAOYSA-N
ID: 45568
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 45569
SMILES:CC1C(O)C(O)C(O)C(Oc2cc3c(cc2C)OC(C)(C)C2C3CC(C)=CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -12.769
InChIKey:GCLJQQQZWXGMEB-UHFFFAOYSA-N
ID: 45570
SMILES:C1CC2C(C)(C)Oc3cc(C)cc(O)c3C12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -19.945
InChIKey:YYDLWMWJHKMZKN-UHFFFAOYSA-N