ID: 39922
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 39923
SMILES:C(CCCC)c1oc2c(c(=O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.153
InChIKey:UQONHODZTKQIFX-UHFFFAOYSA-N
ID: 39924
SMILES:C1=CC2(CO)c3c(O)cc(CCCCC)c(C(=O)O)c3OC(C)(C)C2CC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.434
InChIKey:ZCYRHIVNEDPDIA-UHFFFAOYSA-N
ID: 39925
SMILES:CC1=CC(c2cc(C(=O)OC)c(CCCCC)cc2O)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -13.222
InChIKey:OZAOVKNRDCRSMW-UHFFFAOYSA-N
ID: 39926
SMILES:C1C(C=C)C(CCCC(=C)C)(C)Oc2c(CCC)c(C(=O)OC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.568
InChIKey:KIHQOOQUWLRXPB-UHFFFAOYSA-N
ID: 39927
SMILES:C12=CCC3(C)C4(OC4CC3C3(C)C(C(OC(C=C(C)C)c4cc(O)ccc4O)=O)CC(=O)O3)C1(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.556
CB1 binding score: -16.438
InChIKey:QSASZHUYMUYZPZ-UHFFFAOYSA-N
ID: 39928
SMILES:c1(O)c(C2C(C(C)C)CCC(C)=C2)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.819
InChIKey:RZMKUSQJYZLTNA-UHFFFAOYSA-N
ID: 39929
SMILES:C(=C(C)C)CC1(O)C=C(CO)C(=O)C(CCCCC)=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -16.813
InChIKey:WJURCHGVSRGITM-UHFFFAOYSA-N
ID: 39930
SMILES:C1C(C)=CCC2(OC)C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.682
InChIKey:IRMZHDSEFBSYGH-UHFFFAOYSA-N
ID: 39931
SMILES:C12C(C)(C)C(Br)C(O)CC1(C)Oc1c(c(O)cc(CCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.353
CB1 binding score: -16.796
InChIKey:GYQRPULJRJJEEH-UHFFFAOYSA-N
ID: 39932
SMILES:c1cc2c(c(C)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.626
InChIKey:ZGBGPHGYMDCPCY-UHFFFAOYSA-N
ID: 39933
SMILES:C1=C(C)CC2(O)C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.526
InChIKey:PYZXFULMAXZEJQ-UHFFFAOYSA-N
ID: 39934
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 39935
SMILES:C1(CCCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2)=CC(C(C)(O)C)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.929
InChIKey:RCSWGXRKFIIFTO-UHFFFAOYSA-N
ID: 39936
SMILES:Oc1cc(CCC)cc2c1C1CC(CCC=C(C)C)=CCC1(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -15.519
InChIKey:IENGWSQBAZWCKV-UHFFFAOYSA-N
ID: 39937
SMILES:O=C(C)OCC(=CC(=O)O)CC1(O)C(C=C(C)C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.513
CB1 binding score: -11.886
InChIKey:CBKQCHTZSMWDCA-UHFFFAOYSA-N
ID: 39938
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(CO)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19
InChIKey:AWUDMACGDPCMRJ-UHFFFAOYSA-N
ID: 39939
SMILES:C1(=O)Oc2c(c(O)cc(CCCCC)c2)C2C1C1CC(C)C(O)C(O)C1C(C)(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.183
InChIKey:HYWUXBTWRGJGBL-UHFFFAOYSA-N
ID: 39940
SMILES:C1(C)(C)C2C(c3c(O)cc(CCC)cc3O1)CC(C(C)=C)C(C=Cc1ccc(O)cc1)(C)C(=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: -15.494
InChIKey:BZNRMZWSOKETTK-UHFFFAOYSA-N
ID: 39941
SMILES:C1(C)(C)C2C(c3c(cc(CCCCC)cc3O)O1)C(O)C1=C2CC(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.137
InChIKey:UIIPFFAYBJIFLH-UHFFFAOYSA-N
ID: 39942
SMILES:c1(CO)cc(OC)c2c(c1CCC(C)(C)O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -16.813
InChIKey:RNPOCGVPXJGYGA-UHFFFAOYSA-N