ID: 99730
SMILES:C12=C(C)C(=O)CC13C(C)(CC2)Oc1c(c(O)cc(CCCCC)c1)C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -12.55
InChIKey:LDEWWFNHUVCTOH-UHFFFAOYSA-N
ID: 99731
SMILES:C1CC2(O)C(C)CCCC2(C)Cc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.99
InChIKey:NZUIUJYRHSMUIP-UHFFFAOYSA-N
ID: 99732
SMILES:Oc1c(C(=O)C(CC)C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.563
InChIKey:KFHWFLUEGBMEIL-UHFFFAOYSA-N
ID: 99733
SMILES:C(C(C)=CCOc1c(O)cc2c(c1O)OC(C)(C)C1CCC(C)=CC12)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.958
InChIKey:KAPQBAIPPBEOIG-UHFFFAOYSA-N
ID: 99734
SMILES:C1(c2c(O)cc(CCC)cc2O)C=C(C)CCC1C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 99735
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 99736
SMILES:C1=C(C)C=CC2=C(C)CCC(C(=CCC3OC3(C)C)C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.964
InChIKey:AURAITCJBKMLCC-UHFFFAOYSA-N
ID: 99737
SMILES:C(OC)(=O)CCc1cc2c(c(Cl)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.87
CB1 binding score: -15.162
InChIKey:VMHRFZFXXZAQFS-UHFFFAOYSA-N
ID: 99738
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.188
InChIKey:JCPGMOMTPMEAAR-UHFFFAOYSA-N
ID: 99739
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1=CCC(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.677
InChIKey:PXEYKLACXHEAEY-UHFFFAOYSA-N
ID: 99740
SMILES:O=C(C)CC(C)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.779
InChIKey:IYZIMZZLBWNXFA-UHFFFAOYSA-N
ID: 99741
SMILES:OC(CCC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C(C)(CCC21C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -16.912
InChIKey:GTYYUHWHEHPQHI-UHFFFAOYSA-N
ID: 99742
SMILES:C12CCC(C)C3CC(CO)=CC(O)C3C(C)(CC1c1c(O)cc(CCCCC)cc1O)OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.703
CB1 binding score: -15.453
InChIKey:JQYGPLXZSLHYDW-UHFFFAOYSA-N
ID: 99743
SMILES:c1(CCCCC)cc(O)c2c(c1O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.266
InChIKey:GEEMMNOKGSQDQI-UHFFFAOYSA-N
ID: 99744
SMILES:c1(O)c(CCCCO)cc(O)c(C2C=C(C(O)=O)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -14.575
InChIKey:GCTYNTXCXVCDRY-UHFFFAOYSA-N
ID: 99745
SMILES:C1(O)C(C)(C)Oc2c(c3c(c(O)c2)C=CC(C)(CC=C(C)CCC=C(C)C)O3)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.573
InChIKey:UNUYOVXCUXJGRU-UHFFFAOYSA-N
ID: 99746
SMILES:C=C(C)C1c2c(cc(CCCCC)cc2O)C(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.053
InChIKey:RDXYGFRXVIKQBD-UHFFFAOYSA-N
ID: 99747
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC=C(CO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 99748
SMILES:C12c3c(O)cc(CCC)cc3OC3(C)C(C1C(C)(C)C(OC(C4(C)C(C)O4)=O)C2OC(C)=O)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.578
CB1 binding score: -14.812
InChIKey:GJVNPWHXTNHFLY-UHFFFAOYSA-N
ID: 99749
SMILES:c1(CCC)cc2c(c(O)c1)C1C(C(C)(C)O2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.295
CB1 binding score: -18.235
InChIKey:DFKUIRMHMXKBMJ-UHFFFAOYSA-N
ID: 99750
SMILES:C(CC(C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1C2)=O)(C)CCCC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -17.154
InChIKey:WWERQHGMFLBJGO-UHFFFAOYSA-N