ID: 71065
SMILES:O(C(=O)C)c1c2c(cc(CCCCC)c1)OC(C)(C)C(OC(C(=CC)C)=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -17.205
InChIKey:SOZVUKRUMWYRHX-UHFFFAOYSA-N
ID: 71066
SMILES:CC(=C)C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.184
InChIKey:ZKGKOAJUWMGRFB-UHFFFAOYSA-N
ID: 71067
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 71068
SMILES:C1(C)=CC(c2cc(CCCCC)ccc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 300.486
CB1 binding score: -18.255
InChIKey:FVMNSBXLYRKHTD-UHFFFAOYSA-N
ID: 71069
SMILES:O1C2=Cc3c(cc(CCCCC)cc3O)OC3(C)CC(C2C(C)(O)C)C3C=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.088
InChIKey:RXPIDVGFHIRGHU-UHFFFAOYSA-N
ID: 71070
SMILES:CC1CC2C(C(C)(C)Oc3c2c(OC)cc(C(OC(=O)C(O)(CC)C)=O)c3)C(O)C2OC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.539
CB1 binding score: -15.164
InChIKey:HVLBXQMSDLMUIJ-UHFFFAOYSA-N
ID: 71071
SMILES:Oc1cc(CCCCC)c2c(c1O)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.154
InChIKey:HYXMZOMFKFKNFQ-UHFFFAOYSA-N
ID: 71072
SMILES:C1C(C)=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 71073
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(CCC=C(CCC=C(C)C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.601
InChIKey:JXEWSPILIYHMCP-UHFFFAOYSA-N
ID: 71074
SMILES:c1(CCCCCC)cc2c(c(OC)c1)C1C3C(C=CC3C)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.436
InChIKey:ISGYKIFQTWEDEO-UHFFFAOYSA-N
ID: 71075
SMILES:CC(C)C(c1c(O)cc(O)c2c1OC(C)(C)C1C2C=C(CO)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -18.334
InChIKey:CUCNRHMPQIVVRO-UHFFFAOYSA-N
ID: 71076
SMILES:C=C(CCC(=O)C(C)(C)C)C1c2c(c(OC(C)=O)cc(CCCCC)c2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.288
InChIKey:UBRJEWMKRRRARF-UHFFFAOYSA-N
ID: 71077
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 71078
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 71079
SMILES:O(c1c2c(cc(O)c1C=O)OC(c1cc(O)c3c(c1)OC(C)(C)C1C3C(C)(CCC1C(=C)C)O2)Cl)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.002
CB1 binding score: -16.38
InChIKey:VCKRQCJNRMOZRL-UHFFFAOYSA-N
ID: 71080
SMILES:O(c1cc(CCCC)cc2c1-c1c(c(O)c(CCc3ccccc3)cc1O)OCC2C)C(=O)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.678
CB1 binding score: -12.666
InChIKey:GEMPWFWZCXOHOO-UHFFFAOYSA-N
ID: 71081
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(CCC=C(C)C)C1O2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -12.289
InChIKey:ILVNONZNIGYCFE-UHFFFAOYSA-N
ID: 71082
SMILES:c1(C(CCCO)C)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.204
InChIKey:ZOFNTVPLDJWNMO-UHFFFAOYSA-N
ID: 71083
SMILES:C(CC(C)c1c(C=C(C)C=O)cc(O)c2c1OC(C)(C)C1C2C=C(COC(=O)CC)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.563
CB1 binding score: -13.41
InChIKey:WRKZNMWOITWVQC-UHFFFAOYSA-N
ID: 71084
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 71085
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N