ID: 123313
SMILES:C(c1cc(C2C(C(=C)C)CCC(C)=C2)c(O)c(C=O)c1O)CCC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.116
InChIKey:PZOWTIDJORVJKS-UHFFFAOYSA-N
ID: 123314
SMILES:C(CCCCCCCCCCCc1cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.793
CB1 binding score: -16.604
InChIKey:MBCHEJJIPPBPIH-UHFFFAOYSA-N
ID: 123315
SMILES:c1(C)cccc(O)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.764
InChIKey:VCTOYXGKNMVKJN-UHFFFAOYSA-N
ID: 123316
SMILES:C(C(C)=CCc1cc(O)cc(CCCCC)c1)=CC=C(C)CC(C=C(C)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.923
InChIKey:ANJFIFASEXUFLO-UHFFFAOYSA-N
ID: 123317
SMILES:C12C=CC(OC1=O)C1(C)C(CC(C(=C)C)C2)c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -16.772
InChIKey:QGZYFEFMRUQWBU-UHFFFAOYSA-N
ID: 123318
SMILES:CC1(C)C2C3(C(C)CC(O)C13)C=C(c1c(O)cc(CCCCC)cc1O)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -14.56
InChIKey:CZSZEZTUNUFWMB-UHFFFAOYSA-N
ID: 123319
SMILES:C1C2C(C)(Oc3cc(CCCCC)cc(OC)c31)C1C(CC=CC1CO)C(C)C(C(CC)=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -13.716
InChIKey:SMCWRPYYDGFGGJ-UHFFFAOYSA-N
ID: 123320
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 123321
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(COC)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.929
InChIKey:REUCDKSHZFGLSJ-UHFFFAOYSA-N
ID: 123322
SMILES:C(C=C(C)C)CC(=CCc1c(O)cc(CCc2cc(O)cc(O)c2)cc1OCC=C(C)CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.738
CB1 binding score: -12.165
InChIKey:JFSVUPXQEDIPGD-UHFFFAOYSA-N
ID: 123323
SMILES:C12C3C(C)(CC(O)C1C(C)C)Oc1cc(CCCCC)cc(OC)c1CC2CC=C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -15.272
InChIKey:HRDRHNGUCTYRBY-UHFFFAOYSA-N
ID: 123324
SMILES:[N+](C)(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -15.004
InChIKey:WYYDPPKYEQTCTG-UHFFFAOYSA-N
ID: 123325
SMILES:C1C(C)C(=O)CC2c3c(O)cc(CCCCC)cc3OC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.739
InChIKey:PUJHKHKUKGSJER-UHFFFAOYSA-N
ID: 123326
SMILES:C1C(C(C)C)(OO)C=C(C(C)C)C(c2cc(CCCC)ccc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.929
InChIKey:MHVIEWJDTZOSOT-UHFFFAOYSA-N
ID: 123327
SMILES:CC1C2C(OC1=O)c1c(C)cc(=O)c(OC)c3c1C(C)(C)C(O3)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.584
CB1 binding score: -12.009
InChIKey:DRWIOOQKLXIJRL-UHFFFAOYSA-N
ID: 123328
SMILES:C(C)(Oc1cc(CCCCC)cc2c1C1CC(C)=CC(OC=CC)C1C2(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -17.09
InChIKey:SBBDBYYAVFEVQC-UHFFFAOYSA-N
ID: 123329
SMILES:C(CC1(OC(C)=O)C(=O)C2=C(OC1C(O)(C)C)C1C=C(CO)CCC1C(C)(C)O2)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.599
CB1 binding score: -15.918
InChIKey:YJDIHWIPQGFOCT-UHFFFAOYSA-N
ID: 123330
SMILES:c12c(cc(CCCCC)cc1O)C(C(=C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -17.507
InChIKey:MPSQFQPXBKHQBO-UHFFFAOYSA-N
ID: 123331
SMILES:c1(C)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.752
InChIKey:ZXXLPLVPOBSLTA-UHFFFAOYSA-N
ID: 123332
SMILES:C1(CCC=C(C)C)(C)C(Cc2cc(O)cc(C)c2OC)C(C)=CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -13.494
InChIKey:CMNSIWNPVZOHOJ-UHFFFAOYSA-N
ID: 123333
SMILES:CC(=O)OCc1c(O)cc(CCCCC)cc1C1C(C(C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.792
InChIKey:WECMSYFQYKGCHD-UHFFFAOYSA-N