ID: 53866
SMILES:O1C(=O)C(c2c(O)cc(CCCCC)cc2O)C2C3(C)CCC(C(=C)C)C3C(C)(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -13.198
InChIKey:KVABQQBSYCKXMU-UHFFFAOYSA-N
ID: 53867
SMILES:c1cc(O)c2c(c1C(C)C)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.455
InChIKey:RMNZBBOSEWAEAP-UHFFFAOYSA-N
ID: 53868
SMILES:c1(CC(C(C)(CO)O)O)cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.099
InChIKey:HDCYYDDECRUDSD-UHFFFAOYSA-N
ID: 53869
SMILES:C(=O)(C(=C)Cc1c(O)c(C=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.417
CB1 binding score: -17.683
InChIKey:BPEMEDUDARHCDE-UHFFFAOYSA-N
ID: 53870
SMILES:c1(O)cc(CCCC)cc(C2C=C(C)CCC2C(=C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -17.334
InChIKey:REAAOLDKCGMZTR-UHFFFAOYSA-N
ID: 53871
SMILES:CCOc1c(C)cc2c(c1)-c1c(cc(CCCCC)cc1O)OC21CC(C)CO1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -16.069
InChIKey:DVWOIESYPLOVHM-UHFFFAOYSA-N
ID: 53872
SMILES:Oc1cc(CCCC)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.144
InChIKey:YGFWQASRMDNATQ-UHFFFAOYSA-N
ID: 53873
SMILES:C12C(O)C(C)=CCC1C(C)(C)Oc1c2c(OC)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.492
InChIKey:JRPPVIDGYUWMNF-UHFFFAOYSA-N
ID: 53874
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 53875
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53876
SMILES:C1(O)CC(C)=CC2C1C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 274.36
CB1 binding score: -16.698
InChIKey:IWDTYONXAWFHQB-UHFFFAOYSA-N
ID: 53877
SMILES:Oc1ccc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.493
InChIKey:ITYHJPGRQYSNFQ-UHFFFAOYSA-N
ID: 53878
SMILES:C1C(C)CCC2=C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 53879
SMILES:C1C(C)=CCC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.485
InChIKey:UOLFVTXVWQDBHF-UHFFFAOYSA-N
ID: 53880
SMILES:c12c(c(O)cc(CCCCC)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: 53881
SMILES:C(Cc1c(CCCCC)c(C(=O)OCCCCCC)cc2c1OC(C)(C)C1C2C=C(C)CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.776
CB1 binding score: -15.475
InChIKey:MWPHGTCQMQFDHU-UHFFFAOYSA-N
ID: 53882
SMILES:O1c2c(O)cc(CCCCC)cc2C2C3(C)CCC4C(C)(C3(O)CC4=O)CCC(C)(C)OC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -14.242
InChIKey:CBQOIOMIHCMDKH-UHFFFAOYSA-N
ID: 53883
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 53884
SMILES:CC12C(CCC3(C)OC4=CC(=O)C(=O)C(NCc5ccc(OC)cc5)=CC4=O)(C(C)=CCC31)CC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 549.664
CB1 binding score: -15.603
InChIKey:REYFXCNOXIWGIV-UHFFFAOYSA-N
ID: 53885
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(O)c(C)c(O)cc1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.629
InChIKey:WDTCNWQIKSWMTQ-UHFFFAOYSA-N
ID: 53886
SMILES:c1(O)c(C)c(OC(=O)C)c(OC)c2c1CC1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.05
InChIKey:GFRYJNYZNWXQFP-UHFFFAOYSA-N