ID: 76882
SMILES:C1=C(C)CC2c3c(O)cc(CC)cc3OC1(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.311
InChIKey:PFODCWJQRDYMAD-UHFFFAOYSA-N
ID: 76883
SMILES:CCCC(=O)c1cc2c(c(O)c1)C1C(CCC(C(O)=O)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -14.724
InChIKey:ZMZFJUMCUUAHMH-UHFFFAOYSA-N
ID: 76884
SMILES:CC(C)C1=CCC(O)(C)C2Oc3cc(OC(=O)C)cc(CCCCC)c3C(C2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -11.037
InChIKey:ZRKRJKFWGUWSAT-UHFFFAOYSA-N
ID: 76885
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)C2(C)CCCC(C)(C)C2C(=O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.238
InChIKey:CKHIENZAVZLICN-UHFFFAOYSA-N
ID: 76886
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.215
InChIKey:CQOQZZLLAQHGQU-UHFFFAOYSA-N
ID: 76887
SMILES:CC(OC1C2(C(=O)OC)C(OC(c3c(C)c(Cl)c(=O)c(Cl)c(Br)c3)=O)(C)CCC3(C)C2C(=CCC3)C(C)(C)Oc2cc(CCCCC)cc(O)c21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 822.617
CB1 binding score: -13.188
InChIKey:CJJPWNBIQKDEES-UHFFFAOYSA-N
ID: 76888
SMILES:C1C(C)CC(=O)C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.334
InChIKey:VMDONILZKKAZDT-UHFFFAOYSA-N
ID: 76889
SMILES:CC1(C)Oc2c(c(OC(=O)C)cc(CCCCC)c2)C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 76890
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 76891
SMILES:O=C(CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C(O)(C)C1=O)CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -17.387
InChIKey:SWTMBKLELSIDPD-UHFFFAOYSA-N
ID: 76892
SMILES:C=C(C1C2c3c(cc(CCCCC)cc3O)OC(C)(CC1)C2)C=CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.816
InChIKey:CWAJDPFMYUOLSY-UHFFFAOYSA-N
ID: 76893
SMILES:C1(C)=C2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.334
InChIKey:GCJWCDVNTXLVOB-UHFFFAOYSA-N
ID: 76894
SMILES:CC(O)(C)C12C=CC(=O)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.842
InChIKey:RIFSWBIZIHWDDJ-UHFFFAOYSA-N
ID: 76895
SMILES:CC1(C)C2C(c3c(O)cc(CCCC[N+](C)(C)C)cc3Oc3c(CC=C(C)C)c(O)cc(O)c3C2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.668
CB1 binding score: -16.689
InChIKey:KTEUAYLGFRLNJM-UHFFFAOYSA-O
ID: 76896
SMILES:C1=CC(=O)CCC12c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.299
InChIKey:AVZDYCXTLNOCBM-UHFFFAOYSA-N
ID: 76897
SMILES:Oc1c(C(=CCl)C)c(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.841
CB1 binding score: -14.245
InChIKey:WYIYJWVTISNDOX-UHFFFAOYSA-N
ID: 76898
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCCC)cc2O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.608
InChIKey:YXGBUBWLOJSBDF-UHFFFAOYSA-N
ID: 76899
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.233
InChIKey:LXSFNMQURHTPIT-UHFFFAOYSA-N
ID: 76900
SMILES:C1C2(C)C(C3C(=CC2)C(C)(C)Oc2cc(CCCCC)cc(O)c23)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -12.798
InChIKey:YIWPHACPKBWJBY-UHFFFAOYSA-N
ID: 76901
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.885
InChIKey:ZGTZBRKFZJGQFD-UHFFFAOYSA-N
ID: 76902
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C(O)=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N