ID: 47713
SMILES:CC(C1CCC(C)(O)C2Oc3c(c(O)cc(CCCCC=CC)c3)CC21)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.141
InChIKey:DFRMVRPOWIUNEM-UHFFFAOYSA-N
ID: 47714
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)NCC1OC(CO)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.544
CB1 binding score: -15.68
InChIKey:QFXPBPQHMDQKSJ-UHFFFAOYSA-N
ID: 47715
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N
ID: 47716
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 47717
SMILES:C(OC(=O)C=Cc1cc(O)ccc1)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -16.985
InChIKey:ZOVIPJSPSBYPJS-UHFFFAOYSA-N
ID: 47718
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1=CC3(OC)OC(=O)C(C)=C3CC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -13.853
InChIKey:PEDUSFZYCYHZFJ-UHFFFAOYSA-N
ID: 47719
SMILES:C1C(C)=CCCC2(C)C(=O)C=C(C(C)C)C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -13.721
InChIKey:CWPJYDDCTPTDGB-UHFFFAOYSA-N
ID: 47720
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 47721
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 47722
SMILES:c12c(cc(OC)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.725
InChIKey:DFKRODPVBXERME-UHFFFAOYSA-N
ID: 47723
SMILES:CC(C(OCC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC1(C)OC21)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.988
InChIKey:QATDXTBMEWCQGN-UHFFFAOYSA-N
ID: 47724
SMILES:Oc1cc2c(cc1C)C1C(CCC(C)=CCC=C1C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.554
InChIKey:MYRYKZXDICNKMS-UHFFFAOYSA-N
ID: 47725
SMILES:C(=Cc1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.502
CB1 binding score: -14.527
InChIKey:GCBLXKUVIGDKAC-UHFFFAOYSA-N
ID: 47726
SMILES:OCC1(C)Oc2cc(CCCCC)cc(O)c2C1CC1(C)C(C(C=O)=C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.247
InChIKey:GLFIENKTOUHTHA-UHFFFAOYSA-N
ID: 47727
SMILES:C(CCCCC(OCc1c(CCCCC)cc2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.637
InChIKey:DZVZHUPYSQSJFS-UHFFFAOYSA-N
ID: 47728
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 47729
SMILES:c1c(O)c2c(cc1CCCCC)C1C(CC2)C(C)(OC)CCC(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.092
InChIKey:ZHTNYTIDRXFKRG-UHFFFAOYSA-N
ID: 47730
SMILES:C1(OC(C(=CC)C)=O)C(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.034
InChIKey:WGOQOKMUFIJDIK-UHFFFAOYSA-N
ID: 47731
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C(=O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids;Merohemiterpenoids
MW: 250.294
CB1 binding score: -16.019
InChIKey:OMNGTYDBIBCXMS-UHFFFAOYSA-N
ID: 47732
SMILES:C1(O)(C)C=C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 47733
SMILES:C1C2(Br)C3(C(O)C=C(C)C1)C(C)(C)OC2(Cl)C(=O)c1c(c(C(O)C(CC)O)c(O)c(O)c1)CC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 587.935
CB1 binding score: -14.93
InChIKey:ZDCJNALLVWQGPV-UHFFFAOYSA-N