ID: 53278
SMILES:C1Oc2cc(CCCCC)cc(OC3C(O)C(O)C(O)C(CO)O3)c2C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.453
CB1 binding score: -16.79
InChIKey:DBHMRZMBGGAKQQ-UHFFFAOYSA-N
ID: 53279
SMILES:C1(CC=C(CCC=C(C)C)C)(C)C=Cc2c(O)cc(O)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.66
InChIKey:YJQXKEGFMAULHW-UHFFFAOYSA-N
ID: 53280
SMILES:C1(C(C)C)CC(O)C(C)=CC1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -19.27
InChIKey:NXZMILRKVUHYHW-UHFFFAOYSA-N
ID: 53281
SMILES:C1(O)CCC(=C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.651
InChIKey:YOPFQQDOVYJLRK-UHFFFAOYSA-N
ID: 53282
SMILES:C1CC(C)C2=C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.463
InChIKey:QPWXEBXPSCLNON-UHFFFAOYSA-N
ID: 53283
SMILES:C1=C(C)C(=O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 53284
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 318.457
CB1 binding score: -16.301
InChIKey:WUNYEICTZBRMBM-UHFFFAOYSA-N
ID: 53285
SMILES:C(CCCC)=Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.774
InChIKey:OAXUHIYWRRFWIX-UHFFFAOYSA-N
ID: 53286
SMILES:c1(OC(=O)C)c2c(cc(CCCCC(O)=O)c1)OC1(C3(C)CCC(C1)C3(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.919
InChIKey:ONQUFHPMSVAJIE-UHFFFAOYSA-N
ID: 53287
SMILES:COC(C)(C)C=CCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -17.092
InChIKey:VGPPFZKBYHGIFX-UHFFFAOYSA-N
ID: 53288
SMILES:C1C2=C(C=C(C)C1)C(C)(C)Oc1c2ccc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 240.346
CB1 binding score: -17.624
InChIKey:BHAGHQDOOUUVBH-UHFFFAOYSA-N
ID: 53289
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1CC(CO)C3CCC(C)(O3)CC1C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.485
InChIKey:BZICITOPXNZEKP-UHFFFAOYSA-N
ID: 53290
SMILES:C1C2C3C(CC1(C)CC2)c1c(cc(CCCCC)cc1O)OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.386
InChIKey:AMCNHBFSRGPPNC-UHFFFAOYSA-N
ID: 53291
SMILES:CC1(CCCC(C)(C=C)OC(C)=O)C=Cc2c(cc(C)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -12.984
InChIKey:BKOJEIQBJATTKA-UHFFFAOYSA-N
ID: 53292
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc2c3C(=O)C(O)C(O)(C)C2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -15.051
InChIKey:NYTFKBAHLZVLTN-UHFFFAOYSA-N
ID: 53293
SMILES:c1(O)c2c(cc(C(CCCCC)O)c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.411
InChIKey:QJEZLDCQMLDEKR-UHFFFAOYSA-N
ID: 53294
SMILES:CC1=CC(c2c(O)cc(C)cc2O)C(C(CCC=C(C)C)(O)C)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.449
InChIKey:BVIBXSPONWQDIT-UHFFFAOYSA-N
ID: 53295
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.346
InChIKey:SOTYMVSEDMBMQL-UHFFFAOYSA-N
ID: 53296
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.059
InChIKey:IVRCBDVTRVUPTL-UHFFFAOYSA-N
ID: 53297
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)OC(O)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -13.263
InChIKey:LPDIUVSGZMNPAM-UHFFFAOYSA-N
ID: 53298
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N