ID: 136879
SMILES:C(CC)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC1=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.453
InChIKey:BZQDJHLXAOOUBH-UHFFFAOYSA-N
ID: 136880
SMILES:O(c1cc(OC)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.651
InChIKey:RBOIQFDUPWFAHT-UHFFFAOYSA-N
ID: 136881
SMILES:C1(=O)CC2(C)C(C(C(C)C)(O)CC2)C2C1(C)Oc1c(c(O)cc(CCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.109
InChIKey:UDCDZCGVGBCUMC-UHFFFAOYSA-N
ID: 136882
SMILES:c1(O)c(C2C3C(C)(C)C(C)(CC3)C2=O)cc2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -15.745
InChIKey:CFQIZTXSZBPCPU-UHFFFAOYSA-N
ID: 136883
SMILES:C(O)C1C2Cc3c(O)c(C(O)=O)c(CCCCC)cc3OC2(C)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.411
CB1 binding score: -13.416
InChIKey:BLKVKYQQIUHNSJ-UHFFFAOYSA-N
ID: 136884
SMILES:c12c(O)cc(OC)cc1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.987
InChIKey:WEJIEIZJRLUNOB-UHFFFAOYSA-N
ID: 136885
SMILES:CC12CC(O)C(C)CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.315
InChIKey:OZQOAJCRLYHRGC-UHFFFAOYSA-N
ID: 136886
SMILES:COC12C=COc3c(OC)cc(CCCCC)cc3OC1(C)CCC1C(C)(C)CCCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.257
InChIKey:AMBREEHJVDRYRT-UHFFFAOYSA-N
ID: 136887
SMILES:C1(C(C)C)C(c2c(O)c(CC=C(C)C)cc(CCCC)c2)C(C(=C)C)CCC1(OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.685
CB1 binding score: -16.016
InChIKey:PISKTFNATJZGOP-UHFFFAOYSA-N
ID: 136888
SMILES:c1c(C)cc(O)c(C2C=C(C)CCC2C(=C)C)c1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.827
InChIKey:KZDBMWSJBMYKAQ-UHFFFAOYSA-N
ID: 136889
SMILES:C(C)(=CCCC1(C)C2(Cc3c(c(C)cc(OC(=O)CCCCCC)c3)O2)CCC1Br)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 491.51
CB1 binding score: -14.76
InChIKey:PQVDNNLGMHOVDT-UHFFFAOYSA-N
ID: 136890
SMILES:CC(CCC=C(C)C)(O)C(=O)C1Oc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -17.017
InChIKey:UJKWZJNSVBNYNJ-UHFFFAOYSA-N
ID: 136891
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 136892
SMILES:Oc1cc(C)c(C2C=C(C)CCC2C(=C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.175
InChIKey:GJXWWWKLUZSVGM-UHFFFAOYSA-N
ID: 136893
SMILES:C1CC(C)=CC2C(C(C)(C)Oc3cc(C)ccc32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -15.485
InChIKey:SZDAPTFNKYHNRG-UHFFFAOYSA-N
ID: 136894
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 136895
SMILES:C12C(=O)C=C(C)C1=CC(CC=CC(C)=C)(C)OC(=O)C21OCCCC1OCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.092
InChIKey:ZVZOBCBYWLUOFE-UHFFFAOYSA-N
ID: 136896
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(O)C2(O1)C(C)CC(=O)C(C(CCC=C(C)C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -15.666
InChIKey:MHISKISADPIBDX-UHFFFAOYSA-N
ID: 136897
SMILES:O(C(C)(C)C1CC=C(COC(=O)C(C)C)CC1)c1c(OC)cc(CCCCC)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: Not available
InChIKey:RZNBNTOCVUKRSW-UHFFFAOYSA-N
ID: 136898
SMILES:COc1cc(CCCCC)cc2c1C1CC(C(C)=C)CC(O)C1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.68
InChIKey:JSEIIPNVVGTASZ-UHFFFAOYSA-N
ID: 136899
SMILES:C(C1CC2OC(=O)C(=C)C2CC12C(C)=CCC=C2C)c1c(O)c(C(OCCCC)C)cc(OC)c1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -13.948
InChIKey:LTEKWCVFTIHVNN-UHFFFAOYSA-N