ID: 87844
SMILES:C(C(=O)OC1C(C)=C(c2cc(CCCCC)cc(OC)c2O)C2C(C1)CC(COC(=O)C)=C2)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.763
CB1 binding score: -15.92
InChIKey:SFCRFNFVQQUCKT-UHFFFAOYSA-N
ID: 87845
SMILES:C(Cc1c2c(ccc1CCCCC)OCC2C)=C(CC1C(C(C)=C)CCC1(C(O)=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -15.494
InChIKey:UQKURGGFUFFEMP-UHFFFAOYSA-N
ID: 87846
SMILES:C1CC(C)=CC2C(C(C)(C)Oc3c(C(OC)C)c(OC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.896
InChIKey:LVDZBJJBBSDONA-UHFFFAOYSA-N
ID: 87847
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 87848
SMILES:CNCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -16.339
InChIKey:GSNLUUGDQORSCC-UHFFFAOYSA-N
ID: 87849
SMILES:CC1(C)C2C3C=C(C)C(CC2)OC(=O)C3Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.781
InChIKey:AXAKXANFMBZMMS-UHFFFAOYSA-N
ID: 87850
SMILES:c1(O)c2c(cc(O)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 87851
SMILES:C(CCC)CCCCc1cc(O)c(C2C=C(CCC=C(C)C)C3C2O3)c(O)c1C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.201
InChIKey:YMCRKGDBIXEGLF-UHFFFAOYSA-N
ID: 87852
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.605
InChIKey:FKOKPCOQLHSURS-UHFFFAOYSA-N
ID: 87853
SMILES:c1(O)cc(O)c(C(=O)C(CC)C)c2c1C1C=C(C)C(O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.57
InChIKey:OOPQMQXNNIYNNR-UHFFFAOYSA-N
ID: 87854
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 87855
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.293
InChIKey:VAHUUHMSLIHMFN-UHFFFAOYSA-N
ID: 87856
SMILES:C(CCC(C)=CCc1c(O)cc(C)c(O)c1)C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:RUTPKBVACOSZDU-UHFFFAOYSA-N
ID: 87857
SMILES:C(CCC)Cc1cc2c(cc1O)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.077
InChIKey:NGFPAXCHIPIMOG-UHFFFAOYSA-N
ID: 87858
SMILES:O=S(O)(=O)Oc1c(CC=C(CCC=C(C)C)C)c(O)c2c(c(Cc3c(=O)oc(CCCCC)c4c3C=CC(C)(C)O4)cc(O)c2C(C)C)c1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 708.914
CB1 binding score: -17.404
InChIKey:HPDJHJWNFFCXHU-UHFFFAOYSA-N
ID: 87859
SMILES:C1(C(=C)C)CC(O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C3OC(C)(CCC31)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.283
InChIKey:ZUJVISMIFQFEMB-UHFFFAOYSA-N
ID: 87860
SMILES:C1CC2c3c(cc(CCC)cc3O)OC(C)(C)C2C2CC(C)CCC2C1(c1ccc(CCCCC)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.81
CB1 binding score: -15.945
InChIKey:DHYBUTKSVUSYOC-UHFFFAOYSA-N
ID: 87861
SMILES:c1(O)c(C2C(C(=C)C)CC=C3C2(C)CCOC3=O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.528
InChIKey:BBCSTBYNCNAPNJ-UHFFFAOYSA-N
ID: 87862
SMILES:CCCCCCc1c(C(OC)=O)ccc(C2CC(O)C(C)(C)OC2C(CC)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.591
CB1 binding score: -16.527
InChIKey:ADTSAVNFNJMHTB-UHFFFAOYSA-N
ID: 87863
SMILES:C(NC(CC(c1cc(O)c(C2C(=C(C)C)CCC(C)C2)cc1)=O)CCCCCC)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 455.727
CB1 binding score: -15.23
InChIKey:GVDALWSGPZVJPM-UHFFFAOYSA-N
ID: 87864
SMILES:C(C1=CC2C(=O)C(C(C)=CCC1)CC(C)(C)C2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.459
InChIKey:GBWQNMPAINFXRU-UHFFFAOYSA-N