ID: 49939
SMILES:c1(CCCC(=C)C(CC2C(C)(C)O2)OC(=O)C)cc2c(c(OC)c1)C(=O)OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -13.811
InChIKey:XLIINJPIAFBBTE-UHFFFAOYSA-N
ID: 49940
SMILES:C(CCCCC(=O)OCc1cc(OC)c(CC=C(C)CCC2C(C)(C)O2)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -15.562
InChIKey:BJZCLCPIPLAFEP-UHFFFAOYSA-N
ID: 49941
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 49942
SMILES:C1(C)(C)Oc2cc(CCC)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 49943
SMILES:c1(O)c(CC=C(C)C)c(O)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.085
InChIKey:DXSKUBRMLHRYFY-UHFFFAOYSA-N
ID: 49944
SMILES:C1(C)=CC2C(C(C)(C)Oc3c(C=O)c(C=O)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -16.362
InChIKey:CUKCXRKUMGPSHZ-UHFFFAOYSA-N
ID: 49945
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 49946
SMILES:C1(C(O)C=C(CCC=C(COC(=O)C)C)C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.962
InChIKey:RCTFXVHEDUJUHW-UHFFFAOYSA-N
ID: 49947
SMILES:O1c2c(c(O)c(C(=O)O)c(CCCCC)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 49948
SMILES:O(CCC)c1c(CCCCC)cc2c(c1OC)OC(CCC=C(C)C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.695
CB1 binding score: -14.68
InChIKey:UFYMDWGPAHHMHI-UHFFFAOYSA-N
ID: 49949
SMILES:C1=CC2(CCC(O)(C)CC2)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.329
InChIKey:GQUQDMGXAIVFLN-UHFFFAOYSA-N
ID: 49950
SMILES:CC(=CCCC(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 49951
SMILES:C(CCCC)c1cc2c(c(O)c1C(=O)O)CC(CC=C(C)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.501
InChIKey:OBLNVDYXTHOAGZ-UHFFFAOYSA-N
ID: 49952
SMILES:C1(C)=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: 49953
SMILES:C(CCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.81
InChIKey:KVDBNLOKWYLSLD-UHFFFAOYSA-N
ID: 49954
SMILES:C1CC(C)(CC(C=C(C)C)O)Oc2c1c(O)cc(CCC=CC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.023
InChIKey:CZQLTNGACSCSIM-UHFFFAOYSA-N
ID: 49955
SMILES:C1(C(C)=C)C2OC(=O)c3c(CCCC)cc(O)cc3OC(C2C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.933
InChIKey:NZOHEYRZCGYKHQ-UHFFFAOYSA-N
ID: 49956
SMILES:C1(CO)(C)CCCC2(C)C3C(C(O)CC12)c1c(O)cc(CCCCC)cc1O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.456
InChIKey:GVOUKVOWEKXRKY-UHFFFAOYSA-N
ID: 49957
SMILES:C1=CC(=O)C(CC2C(C(=CC=O)O)(C)Oc3c2c(O)cc(CCCCC)c3)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -14.493
InChIKey:BPNNCILLAUUPNV-UHFFFAOYSA-N
ID: 49958
SMILES:c1(C)cc2c(c(O)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.792
InChIKey:CYTXEQAJNPZCEA-UHFFFAOYSA-N
ID: 49959
SMILES:C(CCC)c1cc2c(c(O)c1)C1C(O)=C(CC3C(C(C)=C)CCC(C)=C3)C(=O)C(C(=O)C(CC)C)=C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -16.178
InChIKey:RMGQTXOMAUVYHN-UHFFFAOYSA-N