ID: 62077
SMILES:Oc1ccc(C2Oc3c(c(O)cc(CCCC)c3)C3C2(C)CCC2C(C)(C)CCCC23C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -16.355
InChIKey:HZJRDEFQLRIFPY-UHFFFAOYSA-N
ID: 62078
SMILES:C=C(C)C1CC=C(C)CC1c1c(O)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.929
InChIKey:HZEYLTTVIULKGA-UHFFFAOYSA-N
ID: 62079
SMILES:c1(CCCCCC)cc(OC(C)CC)c(C2C=C(C)CCC2C(C)=C)c2c1CC(CC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.761
CB1 binding score: -12.717
InChIKey:IILONLWXHQAVHI-UHFFFAOYSA-N
ID: 62080
SMILES:c1(OC)c(C2C=C(C)CCC2C(=C)C)c(O)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.189
InChIKey:XIKSPZHKWNEGGO-UHFFFAOYSA-N
ID: 62081
SMILES:CC(C)(OC)C=CCC1(C)C=Cc2c(cc(O)c(C)c2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.638
InChIKey:VNUZDDIGIZXURK-UHFFFAOYSA-N
ID: 62082
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(cc(-c4ccc(O)cc4)oc3=O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.403
CB1 binding score: -15.341
InChIKey:HEQBKJKGEOSCPK-UHFFFAOYSA-N
ID: 62083
SMILES:C(C(c1c(Oc2c(O)c(CCCCC)cc3c2C2C(CCC(C)=C2)C(C)(C)O3)C(O)C(CC)cc1)O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.742
CB1 binding score: -15.355
InChIKey:QTQCOUSEQGKWEB-UHFFFAOYSA-N
ID: 62084
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 62085
SMILES:C1=C(C=O)CCC(C(C)=C)C1c1c(OC)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -11.791
InChIKey:VNISUBZUEVQHLL-UHFFFAOYSA-N
ID: 62086
SMILES:CC1(C)C2CCC3(C)Oc4c(O)c(CCCCC)cc(O)c4CC3C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.704
InChIKey:RGRYDAIMLAGNJU-UHFFFAOYSA-N
ID: 62087
SMILES:CC(C1CC=C(C)CC1c1c(O)cc(CCCC)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -14.533
InChIKey:GCXBCOCRVMOZDH-UHFFFAOYSA-N
ID: 62088
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 62089
SMILES:C1C(O)C2=Cc3c(O)c(O)c(CCCCC)cc3OC2(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.999
InChIKey:SHXBPNGPIYAKAI-UHFFFAOYSA-N
ID: 62090
SMILES:c1c(C)cc2c(c1)-c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -17.662
InChIKey:XDMUITSUVXRYPV-UHFFFAOYSA-N
ID: 62091
SMILES:C(=CCCC(C)c1ccc(C)c2c(OC)cc(CCCCC)cc2O1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 368.561
CB1 binding score: -14.671
InChIKey:PINODNILSZLELL-UHFFFAOYSA-N
ID: 62092
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 62093
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3C(C(C)C)CCC12C(C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -13.865
InChIKey:LNRCZDGCXKOKKX-UHFFFAOYSA-N
ID: 62094
SMILES:Oc1c2c(cc(O)c1Cc1cc(C)cc(O)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.562
InChIKey:JOBXLODLCMAINC-UHFFFAOYSA-N
ID: 62095
SMILES:C1(C=C(C)C)CC2(C)C(C)(C(=O)c3c(cc(CCc4ccccc4)cc3OC)O2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.577
CB1 binding score: -16.021
InChIKey:MKFAWAGWFVQALA-UHFFFAOYSA-N
ID: 62096
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.943
InChIKey:ZLPWOARYLIQCFD-UHFFFAOYSA-N
ID: 62097
SMILES:CC(C)C=CCC(C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.264
InChIKey:FCYSMYAUJGGJJG-UHFFFAOYSA-N