ID: 94942
SMILES:C12C(C)(CCC(C(C)=C)C1c1c(O)cc(CCCCCO)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -13.561
InChIKey:NQAQAKKACZZTPG-UHFFFAOYSA-N
ID: 94943
SMILES:C(CC(CC1C(CC=C(C)CCC=C(C)C)OC(C)(C)C=C1)O)c1ccc(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.387
InChIKey:OFAWKZJAJRUWCT-UHFFFAOYSA-N
ID: 94944
SMILES:c1(O)ccc2c3c1OC(C)(C)C1CC(=O)C(C)=CC3=CC1(C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.65
InChIKey:PUZMKXKVBCEAAE-UHFFFAOYSA-N
ID: 94945
SMILES:CC(C)C1C(c2c(O)cc(CCCCCO)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.781
InChIKey:CTZSPTCATADZMP-UHFFFAOYSA-N
ID: 94946
SMILES:c1(OC2OC(CO)C(O)C(O)C2O)cc(CCCCC)cc2c1C1C(C(O)(C)CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -14.931
InChIKey:JSBZYBSZVAPAJH-UHFFFAOYSA-N
ID: 94947
SMILES:CC1(C)C(O)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.981
InChIKey:PFVFAVIQMBGGSZ-UHFFFAOYSA-N
ID: 94948
SMILES:CC12CCCC(C)(O)C1CCC(C)C2(Cc1c(OC(C)=O)cc(CCCCC)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.656
CB1 binding score: -12.31
InChIKey:CJSRSTCYSZLVNT-UHFFFAOYSA-N
ID: 94949
SMILES:O1c2c(cc(CCCCC)cc2O)OC1CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.719
InChIKey:SFAFTEGBENQBPR-UHFFFAOYSA-N
ID: 94950
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.585
InChIKey:NZUUGMLOXJAJLR-UHFFFAOYSA-N
ID: 94951
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)c2c(c(C)c1)C1C(CC(C=O)=CC1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.041
InChIKey:FUSILLNRMXGCEW-UHFFFAOYSA-N
ID: 94952
SMILES:CC1(C)OC2(C)C3C(C)(C=CC1=O)CCC(O)C2Oc1c3c(OC(=O)C)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -15.87
InChIKey:SFIYQZPQLPKTBI-UHFFFAOYSA-N
ID: 94953
SMILES:c1(CC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1OC(CC1CC(C(C)C)C=CC1(O)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -16.766
InChIKey:AGIMRSKUQQNOSR-UHFFFAOYSA-N
ID: 94954
SMILES:c1(O)cc(C)c2c(c1-c1c3c(cc(C(C(CC)CC)=O)c1O)OC(C)(C)C1CCC(C)=CC13)occ2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.624
CB1 binding score: -17.143
InChIKey:XSWFUSMVWNGAMF-UHFFFAOYSA-N
ID: 94955
SMILES:C1(O)(C)CCc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -17.974
InChIKey:UWCDDQGADQVJPN-UHFFFAOYSA-N
ID: 94956
SMILES:CCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 94957
SMILES:C(CCC)Cc1cc2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 94958
SMILES:C1=C(C)CCC(C(=C)C(CC=C(C)C)O)C1c1cc(CC(=O)OC)cc(O)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.77
InChIKey:NTEWYCZBDYATIN-UHFFFAOYSA-N
ID: 94959
SMILES:C1=CC(C)(CCC=C(CCC=C(C)C)C)Oc2c1c(O)cc(CCCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -18.334
InChIKey:NADWYTHYDAXNAO-UHFFFAOYSA-N
ID: 94960
SMILES:c1(O)c(CC=C(C)CCC=C(C)CO)c(O)cc(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 348.483
CB1 binding score: -16.372
InChIKey:UABMFXFGODSREC-UHFFFAOYSA-N
ID: 94961
SMILES:Oc1c2c(cc(C(C(OC(=O)C)C(C)(O)C)=O)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.486
CB1 binding score: -15.162
InChIKey:HQRLGFXOAGNIJQ-UHFFFAOYSA-N
ID: 94962
SMILES:C(C)(C)C(=O)c1cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.853
InChIKey:RBDSHGOOOJCPOD-UHFFFAOYSA-N