ID: 14512
SMILES:O=C(C1=CC2c3c(cc(CCCCC)cc3OC)OC(C)(C3CCC(C)=CC3)CC12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -12.987
InChIKey:CFTDMMAQXVPQSO-UHFFFAOYSA-N
ID: 14513
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 14514
SMILES:C1(O)(C)C(O)C2C(C(C)(C)Oc3c(O)c(OC)cc(CCCCC)c3)CCC2(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.644
CB1 binding score: -14.911
InChIKey:YCFRUIZHYNBRFU-UHFFFAOYSA-N
ID: 14515
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C(C(=O)C(C)C)(CC1=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.859
InChIKey:FGFOKZLSZZZTII-UHFFFAOYSA-N
ID: 14516
SMILES:c1(O)c(CC=C(C)CCC=C(CC)CO)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.217
InChIKey:HUPAQLFYWUYTBV-UHFFFAOYSA-N
ID: 14517
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 14518
SMILES:CC1(C)CC(C)C=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -14.989
InChIKey:YGYQXXKRPPOQFO-UHFFFAOYSA-N
ID: 14519
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)c(C(O)=CC(C)C)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.527
InChIKey:GFMLEAJMORDSRB-UHFFFAOYSA-N
ID: 14520
SMILES:Oc1ccc(CCc2cc(O)cc3c2C2CC(C)CCC2C(C)(C)O3)cc1CC(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -11.085
InChIKey:PSHWPZWENVEIRC-UHFFFAOYSA-N
ID: 14521
SMILES:C1(CCC=C(C)C)(C)CC2C13c1ccccc1OC(C)(C)C3CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -15.237
InChIKey:ICIBHBKGCXGNRT-UHFFFAOYSA-N
ID: 14522
SMILES:C1(=O)c2c(cc(CCCCC)cc2O)OC(C)(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.334
InChIKey:HJLDQSFDBVFHQA-UHFFFAOYSA-N
ID: 14523
SMILES:C(C(C)CO)C(c1c2c(c(O)cc1C(C)C)C1C(C(C)(C)O2)CCC(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.232
InChIKey:YJSHSIQVGKUACJ-UHFFFAOYSA-N
ID: 14524
SMILES:Oc1cc(CC=C(C)CCC=C(C)C)c(O)cc1C1C(C(C)=C)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.411
InChIKey:OTFGDCKOPMXBLM-UHFFFAOYSA-N
ID: 14525
SMILES:C1C2C(c3c(O)cc(CCCCC)cc31)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.792
InChIKey:KJSYWEPQKKBLLA-UHFFFAOYSA-N
ID: 14526
SMILES:O(C1C(O)C(O)C(O)C(C(=O)OC)O1)CC1C=CC(C(C)C)(C)C(c2c(O)cc(CCCC)cc2)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.69
CB1 binding score: -14.564
InChIKey:QGEBTJVCJURNMS-UHFFFAOYSA-N
ID: 14527
SMILES:CC(C)C1C(c2c(O)cc(CCCC)cc2O)C(O)C2C(=C)CCC(O)C2(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -12.103
InChIKey:TYQWKJXSAFPKEF-UHFFFAOYSA-N
ID: 14528
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1CC3(O)CCC(C(C)=C)CC3(C)C1(C(OC)=O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -15.494
InChIKey:FBOLXZUIENJXPI-UHFFFAOYSA-N
ID: 14529
SMILES:C1(=O)C=C(CO)C(=O)C2C1c1c(cc(CCCCC)cc1O)OC(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -10.631
InChIKey:PEBXIKXLVRJFLF-UHFFFAOYSA-N
ID: 14530
SMILES:c12c(cc(C3C=C(C)CCC3C(C)C)c(O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.434
InChIKey:KOIJDCKNOGTXEK-UHFFFAOYSA-N
ID: 14531
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 14532
SMILES:c1(O)cc(CCCCC)c(C(=O)O)c(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N