ID: 46033
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1=CC(=O)C(C)(O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.821
InChIKey:QTXUZTKYWAKONT-UHFFFAOYSA-N
ID: 46034
SMILES:C1(O)C(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.628
InChIKey:IERRHQRZTSKZCS-UHFFFAOYSA-N
ID: 46035
SMILES:C1C=C(CO)CCC2C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.336
InChIKey:FWXYDSVCZSIACK-UHFFFAOYSA-N
ID: 46036
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1(O2)C=CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.835
InChIKey:HRHFYLAYWXGDLA-UHFFFAOYSA-N
ID: 46037
SMILES:C(C(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 46038
SMILES:C(=Cc1c(CCC)cc(C2C(C(=C)C)CCC(C)=C2)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.546
CB1 binding score: -14.968
InChIKey:YJULDPHBHFZVDR-UHFFFAOYSA-N
ID: 46039
SMILES:Oc1cc(CCCCC)cc2c1C1(O)CC(C(C)C)C=CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.233
InChIKey:DESBHWRQCHJKRQ-UHFFFAOYSA-N
ID: 46040
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)C(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -14.412
InChIKey:DHIVQTZMGLDGTC-UHFFFAOYSA-N
ID: 46041
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1C(CC=C(COCC=C(C)CCC=C(C)CO)C1)C(C=C(C)C)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.808
CB1 binding score: -16.549
InChIKey:WXNGQDVNFJKEGM-UHFFFAOYSA-N
ID: 46042
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(C)(O)CCCC(C)(C)O2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.149
InChIKey:YTNWBNYTDWKMPO-UHFFFAOYSA-N
ID: 46043
SMILES:CC1(C)Oc2c(ccc(CCCCC)c2O)C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.496
InChIKey:JHNPIFFOLFOHJU-UHFFFAOYSA-N
ID: 46044
SMILES:C(CCCC(c1c2c(ccc1O)OC(C)(C)C1C2CC(C)CC1)C)(C)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -12.767
InChIKey:YCWKIZLLQRZBOE-UHFFFAOYSA-N
ID: 46045
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46046
SMILES:C(C)(=CCCC1=CC2C(CCC(C)=C2)C(C)(C)O1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -16.391
InChIKey:GPRGNYVHSJHLON-UHFFFAOYSA-N
ID: 46047
SMILES:C1(=O)c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(O)(C)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.227
InChIKey:LFFCDSSOJOMTRX-UHFFFAOYSA-N
ID: 46048
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 46049
SMILES:c1(CCCC)cc2c3c(c1)OC(C)(C)C1CCC(C)CC23O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.055
InChIKey:FNGYWUWBOVNENB-UHFFFAOYSA-N
ID: 46050
SMILES:CCOc1c2c(c(Cl)cc1C(C)C)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.914
CB1 binding score: -15.166
InChIKey:YXLXVKUHXIOTAG-UHFFFAOYSA-N
ID: 46051
SMILES:Oc1c2c(cc(CCCC)c1)OC(C)(C)C1C2C=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.144
InChIKey:QVOHZXGDRQEEJT-UHFFFAOYSA-N
ID: 46052
SMILES:C1CC(C(CO)(CC2c3c(cc(CCCCC)cc3O)OC2(C)C)O)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.929
InChIKey:UKZFSAZRQYGWLB-UHFFFAOYSA-N
ID: 46053
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)=CCC1C(C)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 326.524
CB1 binding score: -16.294
InChIKey:NBILDOCAICQKSQ-UHFFFAOYSA-N