ID: 133897
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 133898
SMILES:C1(C(=O)C)=CC2C(C)(Oc3c1cc(CCCCC)cc3OC)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -12.746
InChIKey:ODAHYWYATVTDHX-UHFFFAOYSA-N
ID: 133899
SMILES:C12(Cl)C(Br)c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.837
CB1 binding score: -17.682
InChIKey:MCPBMVPKEHYUQW-UHFFFAOYSA-N
ID: 133900
SMILES:C(CC1C(C)=CC(c2cc(O)ccc2O)C1C(=C)C)(=CC(CC(C)C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.71
InChIKey:WRRIVGNCRSBJMS-UHFFFAOYSA-N
ID: 133901
SMILES:O(CCC(C)=CC(=O)C=C(CCC=C(C)C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -12.881
InChIKey:MPJXHXNIUUKJMO-UHFFFAOYSA-N
ID: 133902
SMILES:c1(C)cc(O)c2c(c1)OC(C)(C)C1=C(C(=O)C(C)CC2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.784
InChIKey:PXFWYYFHKSAJMA-UHFFFAOYSA-N
ID: 133903
SMILES:CC1=C2C3(C(C)C4(C(C)(C)C2CC4)C3)c2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.546
CB1 binding score: -13.53
InChIKey:MQHDILHTVQFTKV-UHFFFAOYSA-N
ID: 133904
SMILES:CC(=CCCC(C)=CCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.148
InChIKey:KVLOTQUKBMKTIL-UHFFFAOYSA-N
ID: 133905
SMILES:C12C(CCC(CO)=C1)C(C)(C)Oc1cc(C(O)CC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.41
InChIKey:RUSYKHXZLAVVKZ-UHFFFAOYSA-N
ID: 133906
SMILES:c1(CC(=O)C)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.103
InChIKey:VWMXULRJAFRZID-UHFFFAOYSA-N
ID: 133907
SMILES:CCc1cc(O)c2c(c1)OC(C)(C)C1C(CC(C)=CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.847
InChIKey:RTAMUXKUEDNNJR-UHFFFAOYSA-N
ID: 133908
SMILES:C(=O)(C=C(C)C)CC1(C)C2CCC(C)(CC2)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.518
InChIKey:PAVKFBXOSFHICC-UHFFFAOYSA-N
ID: 133909
SMILES:C(CCCc1cc2c(cc1C)OC(C)(C)C1CC(C)=CC(O)C12)C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.019
InChIKey:CRBRVSQCNLMPJZ-UHFFFAOYSA-N
ID: 133910
SMILES:c1(O)cc(CCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.687
InChIKey:GXVDYEDWOQVSAM-UHFFFAOYSA-N
ID: 133911
SMILES:C1(C)=CCCC(C)C(=O)C(=O)c2c(O)cc(CCCCC)cc2OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.526
InChIKey:PZNGDOBKCVOQCK-UHFFFAOYSA-N
ID: 133912
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2=CC(=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.266
InChIKey:KWVVHJXZVFZYPC-UHFFFAOYSA-N
ID: 133913
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 133914
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(CC=CC(C)(C)OO)(C)O)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.286
InChIKey:FBGBSLQFCHQBJZ-UHFFFAOYSA-N
ID: 133915
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(O)(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 133916
SMILES:c1(OC)cc(CO)cc(O)c1C1C(C(CCC=C(C)C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.068
InChIKey:SFVMPTBKZQACMY-UHFFFAOYSA-N
ID: 133917
SMILES:C1=CC(CCC=C(C)C)(C)Oc2c(C(C)(C)C=C)cc(O)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.187
InChIKey:KSXJDLDYSZAGFF-UHFFFAOYSA-N