ID: 62434
SMILES:CCCCCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 62435
SMILES:c1(OC)cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 62436
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 62437
SMILES:C1=C2C(CCC=C2CCCC(CCC=C(C)C)(C)O)-c2c(cc(CCCCC)c(C(=O)OC(C)=O)c2O)OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.805
CB1 binding score: -13.657
InChIKey:ZBAIOQWWBOIVHR-UHFFFAOYSA-N
ID: 62438
SMILES:C1C2(C(C)C)Oc3c(c(O)cc(CCC)c3)C2C=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.761
InChIKey:FRUSDDACINOPQM-UHFFFAOYSA-N
ID: 62439
SMILES:C1=C(C)C(OC(C)=O)CC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: Not available
InChIKey:ZHFUMCVFXRLEOJ-UHFFFAOYSA-N
ID: 62440
SMILES:c1(O)c(C=O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CC2(C)C(C1)CCC(C=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: Not available
InChIKey:CXMXWGVZTQSTMY-UHFFFAOYSA-N
ID: 62441
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.197
InChIKey:OFQHNOYVCVEEMU-UHFFFAOYSA-N
ID: 62442
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)=C(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.502
InChIKey:BXSAWMQNDRARAR-UHFFFAOYSA-N
ID: 62443
SMILES:O(C)c1c(O)c(C(C(CC)=O)C)c2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -16.208
InChIKey:DSSXMHYPZBVILQ-UHFFFAOYSA-N
ID: 62444
SMILES:C1=Cc2c(cc(CCCCC)cc2O)OC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 62445
SMILES:Cc1ccc2c(c1)OC(C)(C)C1C2CC(C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 258.361
CB1 binding score: -16.502
InChIKey:PSEYYNAVIQVGQB-UHFFFAOYSA-N
ID: 62446
SMILES:C(Oc1c2c(c(O)cc1CC(=O)O)OC(C)(C)C1CC=C(C)CC21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.12
InChIKey:PHSGBYORLSDYIN-UHFFFAOYSA-N
ID: 62447
SMILES:C(CC)(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)C(=O)C21O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.971
InChIKey:BAYDKKPFMDWOEZ-UHFFFAOYSA-N
ID: 62448
SMILES:c1(O)cc(OC)c2c(c1C)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.327
InChIKey:QTCSUUUZRLLBQN-UHFFFAOYSA-N
ID: 62449
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC(C(C)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.767
InChIKey:BQDYOFZEOBNYBA-UHFFFAOYSA-N
ID: 62450
SMILES:Oc1cc2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.091
InChIKey:DENJPBAXNZGHTK-UHFFFAOYSA-N
ID: 62451
SMILES:C1C=C(C(CC2C(C)(C)O2)OC(=O)C)Cc2c(c(C)cc(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.795
InChIKey:QPGBUGXRJKRSDP-UHFFFAOYSA-N
ID: 62452
SMILES:c1(O)c(C(C(CCCCC)O)O)cc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -16.104
InChIKey:GJEWNTYPFSUNPF-UHFFFAOYSA-N
ID: 62453
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -17.811
InChIKey:XGUNHTRLRAWUSH-UHFFFAOYSA-N
ID: 62454
SMILES:CC1C(=O)CCC(=C)C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.346
InChIKey:QGMXRZWHPNTMQW-UHFFFAOYSA-N