ID: 2983
SMILES:CC1(C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 2984
SMILES:c12c(O)cc(CCCC)cc1OC(C)(C)C1=C(C2=O)C(O)C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.508
InChIKey:KNJFNSJNCGRGJC-UHFFFAOYSA-N
ID: 2985
SMILES:C(CCCc1cc(CC2C=C(C)C(CC=C(C)C)OC2=O)cc(O)c1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -17.678
InChIKey:INQCIKFJWHMZEU-UHFFFAOYSA-N
ID: 2986
SMILES:C(C=C(C)C)(CC(c1c(O)cc(O)c2c1OC(C)(C)C1CC=C(C)CC21)CC=C(C)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.077
InChIKey:MBEYOCXHJHQYBU-UHFFFAOYSA-N
ID: 2987
SMILES:CC1=CC(c2c(O)cc(CCCCCO)cc2O)C(C(=CCC=C(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.283
InChIKey:GVVAWQQZYJUHEO-UHFFFAOYSA-N
ID: 2988
SMILES:c1(OC)cc2c(cc1CCCCC)OC1C3CC(C(C)(C)O)OC3=CC(C2=O)C(OC(=O)C(=CC)C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.67
CB1 binding score: -15.824
InChIKey:AFGFATFGMAJBOH-UHFFFAOYSA-N
ID: 2989
SMILES:CC(C1=CCC(c2c(O)cc(CCCCC)cc2O)CC1)C(O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.707
InChIKey:PQXLPUPAJOPXGG-UHFFFAOYSA-N
ID: 2990
SMILES:C(CCCCc1cc2c(c(O)c1)C13C(CC(O)C(C)(C)O1)OC(=O)C2(C)CC3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.905
InChIKey:KERDHHJDMQAQTH-UHFFFAOYSA-N
ID: 2991
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 2992
SMILES:c1(C(O)C(O)C)cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -14.322
InChIKey:JTQNSDTWEWIQNR-UHFFFAOYSA-N
ID: 2993
SMILES:CC(C1C2CC(C)=CC2c2c(O)cc(CCCCC)cc21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.434
InChIKey:WINRODKEFMQDPK-UHFFFAOYSA-N
ID: 2994
SMILES:C(C)CCc1cc2c(c(O)c1)C1C3C(C)(C=CC(=O)C3(C)C3C1C3)C1C(C1C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -13.124
InChIKey:LLUYREKTYQNURY-UHFFFAOYSA-N
ID: 2995
SMILES:C1(c2c(O)cc(O)cc2CCC=C(C)C)C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.547
InChIKey:UFYAJFAOEPDOIL-UHFFFAOYSA-N
ID: 2996
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 2997
SMILES:C1(c2cc(CCN(C)C)ccc2O)C=C(C)C(O)CC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -15.945
InChIKey:WKIJWHSQDNQSMD-UHFFFAOYSA-N
ID: 2998
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 2999
SMILES:Oc1ccc(OC)c2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.369
InChIKey:JIXXNDJWTGILQE-UHFFFAOYSA-N
ID: 3000
SMILES:CC1(C)C(CCC2(C)C=Cc3c(c(C)cc(O)c3O)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -16.517
InChIKey:ZIXZHLSIXYSNIH-UHFFFAOYSA-N
ID: 3001
SMILES:C1(C)(C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 3002
SMILES:C1(C)c2c(cc(C)cc2O)OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 206.285
CB1 binding score: -17.765
InChIKey:LXWUGDOYFGGLTN-UHFFFAOYSA-N
ID: 3003
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC(C)(O)C)C(C)(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -16.255
InChIKey:SARLSNMACPAIBP-UHFFFAOYSA-N