ID: 55735
SMILES:C1=C(C)CCC(C(=C)C)=C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.102
InChIKey:WYXBQMBTZPCTQC-UHFFFAOYSA-N
ID: 55736
SMILES:CC1(C)CC2(Oc3c(c(OC)cc(CCCCC)c3)C2)C2C1CC(O)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.277
InChIKey:AGHDJVJROSJUHA-UHFFFAOYSA-N
ID: 55737
SMILES:C12Cc3c(O)c(C(=O)O)c(CCC)cc3OC1(CO)CCC(C(C)=C)C2C=CC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.178
InChIKey:AOOGMFDQJPCWRV-UHFFFAOYSA-N
ID: 55738
SMILES:C(O)(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC(C)=O)c23)CCC2(C)CCC(=C(C)C(=O)O2)C=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.692
CB1 binding score: -14.523
InChIKey:CTKCUFFLGYPGBW-UHFFFAOYSA-N
ID: 55739
SMILES:C1(O)C(C)(C)OC2=C(C(=O)C(C(C(OC(C)=O)C(CC)C)C)=CC2=O)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.437
InChIKey:HZRKYAVVRLTJCR-UHFFFAOYSA-N
ID: 55740
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.721
InChIKey:ULZHEUZUAQGXNB-UHFFFAOYSA-N
ID: 55741
SMILES:C(CCCC)Cc1c(C2C=C(CO)CCC2C(=C)C)c(O)c(C=O)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.29
InChIKey:VOBRADUPUKIRSE-UHFFFAOYSA-N
ID: 55742
SMILES:C(=CC)(C)C(OCc1cc(OC)c2c(c1)C=CC(CCC=C(C)C)(C)O2)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.951
InChIKey:ABJFRQVMBVEBNX-UHFFFAOYSA-N
ID: 55743
SMILES:O=c1ccc2c(c(CCCCC)c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.972
InChIKey:LGZGFGSWEAMWNJ-UHFFFAOYSA-N
ID: 55744
SMILES:c1(OC)cc(OC)cc2c1CC1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -13.118
InChIKey:FGXUUMSFTUOTQT-UHFFFAOYSA-N
ID: 55745
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(O)C(CO)(O)CC1(C)CC2C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.369
InChIKey:XFXIBYKSPSLRAB-UHFFFAOYSA-N
ID: 55746
SMILES:O=C1C(C)=CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.439
InChIKey:NXWXGRHVAFTVMW-UHFFFAOYSA-N
ID: 55747
SMILES:C1(C)(CCC(O)c2ccccc2)CCCC(=C)C(O)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.754
CB1 binding score: -16.893
InChIKey:VFGYPAVZTLZPCC-UHFFFAOYSA-N
ID: 55748
SMILES:c12c3c4c(cc1OC(C)(C)C1C3C(C)(C)C1CC2)OC4(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -13.807
InChIKey:JMKSCBIKYRVONP-UHFFFAOYSA-N
ID: 55749
SMILES:C(CC)=CCc1cc(OC)c2c(c1)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:PWEMIPHMADOCIB-UHFFFAOYSA-N
ID: 55750
SMILES:C1(C)(CCC2(C)C(C)CC(O)CC(C)(CO)O2)Oc2c(cc(C)c(C)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.556
InChIKey:CWQCHCVXXZQKBC-UHFFFAOYSA-N
ID: 55751
SMILES:c1(O)c2c(c3c(c1)OC(C)(C)C1C3C=C(CO)CC1)CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.833
InChIKey:PRSRLYFZKQVURI-UHFFFAOYSA-N
ID: 55752
SMILES:C(C(C)=CCCC1(C)Oc2cc(CCCCC)cc(=O)c(O)c2CC1O)CC(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -15.957
InChIKey:ZWUWIIITTSOODV-UHFFFAOYSA-N
ID: 55753
SMILES:C1C2C(C)(C)Oc3c(C)c(C(=O)C(CC)C)c(O)c(O)c3OC2(C)CCC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.966
InChIKey:RXELTKZRIHXMQA-UHFFFAOYSA-N
ID: 55754
SMILES:C(CCCCC)CCCC12C(=O)OC(c3c(O)cc(CCCCC)cc3O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -12.991
InChIKey:AZMZAWOZRMYAIA-UHFFFAOYSA-N
ID: 55755
SMILES:C1(C(C)=O)CCC(C)CC1c1c(O)c(C(OC)=O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.42
InChIKey:XJFXXSRVMNNXOV-UHFFFAOYSA-N