ID: 86752
SMILES:c12c3c(c(=O)ccc1OC(C)(C)C1CCC(C)=CC13)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.288
InChIKey:CQUKJOLKLKHBSY-UHFFFAOYSA-N
ID: 86753
SMILES:C12=CCCC(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.468
InChIKey:VCPTUYNRNHXIHF-UHFFFAOYSA-N
ID: 86754
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -16.891
InChIKey:VBGLJIFFNSKSNQ-UHFFFAOYSA-N
ID: 86755
SMILES:C1(C(C)(C)O)CC2(c3c(cc(CCCCC)cc3O)OC2=O)CC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.044
InChIKey:IMMLGMUOQZCDNM-UHFFFAOYSA-N
ID: 86756
SMILES:c1(CCCCC)cc2c(c(O)c1)CC1C(C)(O2)CCC(C(O)(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.732
InChIKey:SNLWQEOGBVQFHE-UHFFFAOYSA-N
ID: 86757
SMILES:C(C=C(C)C)(CC(C)=CCc1c(O)c2c(c(C(=O)C(C)CC)c1O)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 494.672
CB1 binding score: -18.687
InChIKey:UXMQFFOPMMIFHH-UHFFFAOYSA-N
ID: 86758
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(CO)C(=O)C1CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.605
InChIKey:QFOICHAVSYBNGF-UHFFFAOYSA-N
ID: 86759
SMILES:c1(C(CCl)OC2C(O)OC(CO)C(O)C2O)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.973
CB1 binding score: -14.059
InChIKey:DWFNXLJQPIGMDG-UHFFFAOYSA-N
ID: 86760
SMILES:C1C2=C(c3c(cc(CCCCC)cc3O)OC2(C=C)C)OC(C)C1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.254
InChIKey:GZHPZZPSBMYZEK-UHFFFAOYSA-N
ID: 86761
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 86762
SMILES:C(CCc1cc(O)c(C2C(C(C)=C)CC(O)C(C)=C2)cc1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.929
InChIKey:ROUQMVALCMMHMO-UHFFFAOYSA-N
ID: 86763
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(CCC=C(C)C)C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.648
InChIKey:LULABODDSLMALF-UHFFFAOYSA-N
ID: 86764
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 86765
SMILES:C1C2C(C(C)(C)Oc3c2c(O)cc(CCCCCC)c3)C2CC(C)CCC2=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.377
InChIKey:IMUIBCZPPBSYHP-UHFFFAOYSA-N
ID: 86766
SMILES:CCCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 86767
SMILES:C1CC2CC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.141
InChIKey:OJRKFOLLPFUYIA-UHFFFAOYSA-N
ID: 86768
SMILES:C1C(C(C)C)C(c2c(O)c(C(O)=O)c(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -18.276
InChIKey:NGHGOJRQIYPXBS-UHFFFAOYSA-N
ID: 86769
SMILES:C12(C(C)(C)Oc3cc(C)cc(O)c31)CC(=O)CC(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.04
InChIKey:DWKVYIXJNLYSJK-UHFFFAOYSA-N
ID: 86770
SMILES:C=C1C2CCC(C)=CC2c2c(O)cc(CCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.075
InChIKey:OGAPRUQGMXNCAY-UHFFFAOYSA-N
ID: 86771
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 86772
SMILES:CCCCCCCCc1cc(O)c2c(c1)C1OCC(=C1)CCC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.929
InChIKey:QZKSLTYWXJYHJC-UHFFFAOYSA-N