ID: 111532
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 111533
SMILES:CC1=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 111534
SMILES:C1CC(C)(C)C2C3OC(C)(C)Oc4cc(CCCCC)cc(O)c4C3C(O)(C)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.683
CB1 binding score: -12.024
InChIKey:BAMGXJHKKMQYHS-UHFFFAOYSA-N
ID: 111535
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N
ID: 111536
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C=C2C(C(=C)CCC3OC3(C)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.911
InChIKey:JNUBXWLDKVMTPQ-UHFFFAOYSA-N
ID: 111537
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)C)CCC1(O)CC(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.178
InChIKey:DTTDJLNNIVWFNL-UHFFFAOYSA-N
ID: 111538
SMILES:CC(C1=CCC(O)(C)C2Oc3cc(C(CCCCC)O)c(O)c(C)c3C12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -11.546
InChIKey:IECFRUWFRAKBBB-UHFFFAOYSA-N
ID: 111539
SMILES:C(Cc1cc(O)c2c(c1)OC1(C)CCC(OO)C(C)(C)C1C2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.724
InChIKey:OKYHUUASCRGACY-UHFFFAOYSA-N
ID: 111540
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCC)cc2O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.818
InChIKey:ZHKVVCCXKGADKK-UHFFFAOYSA-N
ID: 111541
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 111542
SMILES:CC1(C)CCCC2=C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.481
InChIKey:WVPDBUWIURLEBC-UHFFFAOYSA-N
ID: 111543
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 111544
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.384
InChIKey:UWEADTQGGMWRLM-UHFFFAOYSA-N
ID: 111545
SMILES:COc1ccc(CCCCC)cc1-c1c(O)c2c(cc1C)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -13.842
InChIKey:KHMPNFLBLPDFCA-UHFFFAOYSA-N
ID: 111546
SMILES:CC(=CCc1c(OC(C)=O)cc(CCCCC)cc1OC(C)=O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -17.009
InChIKey:CQXYYVMHDFTWJQ-UHFFFAOYSA-N
ID: 111547
SMILES:C(=C(C)C)CCC(=CCC1(c2c(O)cc(OC)cc2CCCCC)C(O)CC1C(=C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -12.71
InChIKey:QGMIWQUOMFGPDM-UHFFFAOYSA-N
ID: 111548
SMILES:CC1(CCC=C(C)C)C2C(c3c(O)cc(C)cc3O1)OC(=O)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 330.424
CB1 binding score: -16.147
InChIKey:AIPUAGTXJBXSQC-UHFFFAOYSA-N
ID: 111549
SMILES:OC1C(=C)CCC2C1C(C)(C)Oc1cc(O)cc(C)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -13.693
InChIKey:WGDSRXGSWJFZGM-UHFFFAOYSA-N
ID: 111550
SMILES:C(C)(C)=C1CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.908
InChIKey:RRCLLEORADOMNB-UHFFFAOYSA-N
ID: 111551
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(CCC=C(CC=CC(C)(OO)C)C)C1=CC)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.187
InChIKey:ARDPJLKKHDNNHI-UHFFFAOYSA-N
ID: 111552
SMILES:CC(C)=CCc1c(O)cc(CCCCC)cc1OC(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -18.614
InChIKey:RTFRSXSQUQOXEP-UHFFFAOYSA-N