ID: 112561
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N
ID: 112562
SMILES:C1CC(C(C)=C)C(c2c(O)cc(C)cc2OC(=O)C)OC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.929
InChIKey:FBTPUJMVBAAMDH-UHFFFAOYSA-N
ID: 112563
SMILES:c1(OC)c2c(cc(O)c1C)C1C(C(C)(C)O2)CCC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.938
InChIKey:UFKNIHKJKXDPSJ-UHFFFAOYSA-N
ID: 112564
SMILES:c1(CCCCC)c(C(=O)O)c(O)c2c(c1)C1C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.901
InChIKey:LPGNKSYZQHRTCP-UHFFFAOYSA-N
ID: 112565
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 112566
SMILES:c1(C(C)C)c(C(OCC(=O)CCCCCC)=O)c(C)cc2c1CC(O)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -16.546
InChIKey:UBKKCXLIWLXQLY-UHFFFAOYSA-N
ID: 112567
SMILES:c1c(O)c(C(=O)O)cc2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -16.904
InChIKey:WFGSPMRGIWGKMK-UHFFFAOYSA-N
ID: 112568
SMILES:c1cc(O)cc2c1-c1c(O)cc(CCCCC)cc1OC2C(CC=C(C)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -14.058
InChIKey:YXIZNPBRSODJQK-UHFFFAOYSA-N
ID: 112569
SMILES:c1cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 112570
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 112571
SMILES:C1CC2C3(CC1C3(C)C)Cc1c(O)cc(CCCCC)cc1OC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.83
InChIKey:HJUVGTPWLRUDBZ-UHFFFAOYSA-N
ID: 112572
SMILES:C12(c3c(O)cc(CCCCC)cc3OC1(C)CO)CCC1(C)Oc3c(cc(O)cc3C)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -15.795
InChIKey:MIMRFEHOTWXBBM-UHFFFAOYSA-N
ID: 112573
SMILES:C(CC)(O)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.219
InChIKey:MLRBLGBILHQUFP-UHFFFAOYSA-N
ID: 112574
SMILES:c1(CC=CCC)ccc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.669
InChIKey:LYFBZMZNIMXCNZ-UHFFFAOYSA-N
ID: 112575
SMILES:C(=O)(OC)c1c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.379
CB1 binding score: -14.668
InChIKey:ANJUPKNQOGKMPZ-UHFFFAOYSA-N
ID: 112576
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -16.173
InChIKey:HGAAYWBASODVBC-UHFFFAOYSA-N
ID: 112577
SMILES:CCCc1cc(OC)c(O)c2c1OC1(C)CCC(C(C)=C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.511
InChIKey:CRLJNGJTKVFTJB-UHFFFAOYSA-N
ID: 112578
SMILES:O1C(C)(C)CCC(O)C(C)=CC1c1c(OC)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -14.884
InChIKey:HHGLRZLBCSSUKZ-UHFFFAOYSA-N
ID: 112579
SMILES:C1C2(C)C(C(C3CC(Br)C(C)(C)O3)C1)C(c1c(O)cc(CCCCC)cc1O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 465.472
CB1 binding score: -15.929
InChIKey:JJZPOXNPGQIUEX-UHFFFAOYSA-N
ID: 112580
SMILES:c1c(CCCCC)cc2c(c1O)C(=O)C1=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.912
InChIKey:ICKLEZDNADXJLW-UHFFFAOYSA-N
ID: 112581
SMILES:Cc1c(OC)c(Br)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 367.283
CB1 binding score: -14.026
InChIKey:FREJUAYVJQJRIY-UHFFFAOYSA-N