ID: 97966
SMILES:COc1c(C(=O)C(C)C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.824
InChIKey:WHKFILSMPAXSLV-UHFFFAOYSA-N
ID: 97967
SMILES:C(C(c1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=O)(=O)C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -15.321
InChIKey:AOBVSNWTMLUQRJ-UHFFFAOYSA-N
ID: 97968
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C(C=C(C)CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.801
InChIKey:NSDOSVJJRXZCDP-UHFFFAOYSA-N
ID: 97969
SMILES:C(CC1(C)C2=C3C(CCC2(C)O)C(C)=CC(c2c-3cc(CCCCC)cc2OC)O1)(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -16.502
InChIKey:XGWZKJIOINPXFP-UHFFFAOYSA-N
ID: 97970
SMILES:C(=O)(C)C1=CC2=CCCCC(C)(CC3C(O3)C(C)(C)Oc3cc(CCCCCC)cc(O)c32)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.644
CB1 binding score: -14.605
InChIKey:WJQSWIYTSSVDDB-UHFFFAOYSA-N
ID: 97971
SMILES:O(c1c(O)c(O)cc(CCc2cc(OC)c(O)c(CC=C(CCC=C(C)C)C)c2)c1)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -18.075
InChIKey:VORTVYVIQDNSID-UHFFFAOYSA-N
ID: 97972
SMILES:c1(CC(O)CCC)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.166
InChIKey:PVRJAZVKVQMBIZ-UHFFFAOYSA-N
ID: 97973
SMILES:C12Oc3c(c(O)cc(CCCC)c3)C(C1(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -8.607
InChIKey:RMNRJKTZPUHLMU-UHFFFAOYSA-N
ID: 97974
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C3C(C)(C2C(C=C(C)C)CC3(C)O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.305
InChIKey:VPITZCOXKKNQDI-UHFFFAOYSA-N
ID: 97975
SMILES:C(CCC(c1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2)C)(C)=CCC(C1(C)OC(=O)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -15.858
InChIKey:VVBPRIJXXBRDIH-UHFFFAOYSA-N
ID: 97976
SMILES:C(C)(CC(=O)c1c(O)c2c(cc1O)OC(C)(C)C1CC=C(C(=O)O)CCC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.034
InChIKey:HARZAWCHUZOUEU-UHFFFAOYSA-N
ID: 97977
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.882
InChIKey:UEFGHYCIOXYTOG-UHFFFAOYSA-N
ID: 97978
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 97979
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 97980
SMILES:C1(OO)C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.911
InChIKey:WECTWGOJENOUAH-UHFFFAOYSA-N
ID: 97981
SMILES:C1(C)=CC(c2c(OC)c(C(=O)CCCCC)cc(OC(=O)C)c2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: Not available
InChIKey:VUGFCCHJWZHRTB-UHFFFAOYSA-N
ID: 97982
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.742
InChIKey:VNRLFKGINFBEHO-UHFFFAOYSA-N
ID: 97983
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 97984
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 97985
SMILES:C=CCCCc1cc(OC)c2c(c1)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -14.115
InChIKey:KBZBUGKLFQJEAH-UHFFFAOYSA-N
ID: 97986
SMILES:c12c(c(OC)cc(O)c1Cc1c(O)cc(CCCCC)cc1O)cc(O)c(C1C(O)(C)CCC1C(=C)C)c2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.665
CB1 binding score: -14.526
InChIKey:DBTCFMPKTKQAKB-UHFFFAOYSA-N