ID: 113023
SMILES:CC1(C)C2CC=C(CO)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 113024
SMILES:Oc1cc(CCCCC)cc2c1C1C=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: 113025
SMILES:C1(C)(O)CCC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 113026
SMILES:O(C(C)=O)C1CC2C(C)(C)Oc3cccc(C)c3C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.014
InChIKey:XODVBGCVSHHWFL-UHFFFAOYSA-N
ID: 113027
SMILES:c1c2c(cc(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 113028
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 113029
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 113030
SMILES:C1CC(C)=CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.211
InChIKey:JPUKUVZVEGROFO-UHFFFAOYSA-N
ID: 113031
SMILES:COc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(CO)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.659
InChIKey:BTFFHUBEVPOVDC-UHFFFAOYSA-N
ID: 113032
SMILES:C(CC1(C)C(O)Cc2c(O)cc(CCCCCC)cc2O1)C(C(CC(C)C)=O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -16.432
InChIKey:KMLRQJHMYRJGIE-UHFFFAOYSA-N
ID: 113033
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(CC=C(C)C)(C1=O)C(=O)C=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -14.803
InChIKey:BGEHKADIUGEACY-UHFFFAOYSA-N
ID: 113034
SMILES:C12C(=C(Cl)C(O)C(Cl)C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 385.331
CB1 binding score: -12.271
InChIKey:LSLIRPOIQFTLKF-UHFFFAOYSA-N
ID: 113035
SMILES:O=C1C=C(CC2C(=O)c3c(O)cc(CCCCC)cc3OC2(C)C)C(=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.417
CB1 binding score: -15.549
InChIKey:LELMLACTKIPWAS-UHFFFAOYSA-N
ID: 113036
SMILES:O=C(c1c(O)c(C=O)c(O)c(C2C(C(=C)C)CCC(C)=C2)c1OC)C=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -16.706
InChIKey:BACGFGKICWLXQT-UHFFFAOYSA-N
ID: 113037
SMILES:C(c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -17.479
InChIKey:CXRSPYMYNPYCMM-UHFFFAOYSA-N
ID: 113038
SMILES:CC1(C)C(c2cc(CCCCC)cc(O)c2)(O)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -14.151
InChIKey:IBPXVPYSOHHCTC-UHFFFAOYSA-N
ID: 113039
SMILES:C(Cc1c(O)c(C(=O)CC(C)C)c2c3c1OC(C)(C)C1C(=O)OC(C)(CCC1O)C23)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.161
InChIKey:UZUFDRSISWFDIN-UHFFFAOYSA-N
ID: 113040
SMILES:c1(OS(=O)(O)=O)c(CC=C(C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.457
CB1 binding score: -14.541
InChIKey:RZNUWSHDSHPNTR-UHFFFAOYSA-N
ID: 113041
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(C2O)CCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -14.019
InChIKey:MTIKCJPTMORFNY-UHFFFAOYSA-N
ID: 113042
SMILES:c1c(O)c2c(cc1CCCCC)C(C)(C)C(=O)CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.522
InChIKey:KTWJHYQWPDGZRF-UHFFFAOYSA-N
ID: 113043
SMILES:C(CCc1c(C2C(C(C)=C)CCC(C)=C2)c(OC(C)=O)c(O)c(C)c1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -10.708
InChIKey:XAPQACVJHHOYPN-UHFFFAOYSA-N