ID: 92800
SMILES:CCCCCCc1cc2c(c(O)c1)OC(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.015
InChIKey:YYZLCQMBLHYFFO-UHFFFAOYSA-N
ID: 92801
SMILES:O1C(CO)C(O)C(O)C(O)C1OC(C1=CC2c3c(cc(C)cc3O)OC(C)(C)C2CC1=O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.467
CB1 binding score: -14.631
InChIKey:IGGFNBZBFMMIRK-UHFFFAOYSA-N
ID: 92802
SMILES:c1(CCCCC)c(O)c2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.778
InChIKey:XZZRIGWRTMXFNI-UHFFFAOYSA-N
ID: 92803
SMILES:CC1(C)Oc2c(c(O)c(O)cc2C)C2C(O)C(=C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -14.956
InChIKey:AYJLURBOONCIQU-UHFFFAOYSA-N
ID: 92804
SMILES:CC1C2CCC(C)=CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.783
InChIKey:IBFJEMWRCRTHCR-UHFFFAOYSA-N
ID: 92805
SMILES:C(CC)CCCc1cc2c(cc1O)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.119
InChIKey:YJBACYJGJWKZBF-UHFFFAOYSA-N
ID: 92806
SMILES:O(c1cc(CCCCC)c2c(c1)C1CC(C)=CCC1C2(C)C)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -15.929
InChIKey:LPNOQUZYBOOOOG-UHFFFAOYSA-N
ID: 92807
SMILES:C1=CC2(C)OC(C)(C)C1Cc1cc(c(C)cc1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: Not available
InChIKey:HDPNMOBPUKEMGF-UHFFFAOYSA-N
ID: 92808
SMILES:C(Cc1c2c(ccc1O)OC(C)(C)C1C2CC(C)=CC1)(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.929
InChIKey:CIHGONOFAUBGLW-UHFFFAOYSA-N
ID: 92809
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.946
InChIKey:ZZWBNNWUXWMLHU-UHFFFAOYSA-N
ID: 92810
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92811
SMILES:C1C(c2c(O)cc(CCCCC)cc2)(C)C(=O)C2=CCCC(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.949
InChIKey:DSGGLVRKBJNCCB-UHFFFAOYSA-N
ID: 92812
SMILES:O(C)c1cc(CCCCC)cc2c1C1C(C(OC(=O)C)CC(C)=CCC2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.325
InChIKey:NXRORQJRAMEMCK-UHFFFAOYSA-N
ID: 92813
SMILES:COc1c(O)ccc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.057
InChIKey:FJKAXMDZIZCUDM-UHFFFAOYSA-N
ID: 92814
SMILES:C(CCC(C)=CCc1c(O)c(CC=C(C)C)cc(O)c1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 92815
SMILES:C1(=C)C=C2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.44
InChIKey:KJWARAZFZUTBKD-UHFFFAOYSA-N
ID: 92816
SMILES:C1C2C(C)(Oc3cc(CCC)cc(O)c32)C=C(C)C(CCO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.713
InChIKey:KNROWNNFYVRXEU-UHFFFAOYSA-N
ID: 92817
SMILES:C(C=C(C(Cl)CC=C(C)C)C)c1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.939
CB1 binding score: -17.997
InChIKey:LPIFXHILVKTEGU-UHFFFAOYSA-N
ID: 92818
SMILES:C1C(C)=CC2c3c(ccc(OC)c3)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.071
InChIKey:QJRPBWFSXAYWJJ-UHFFFAOYSA-N
ID: 92819
SMILES:C(=C)(C1CCC(C)=CC1c1c(O)cc(C)cc1OC)C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.098
InChIKey:QJCNMYPTFKIDSH-UHFFFAOYSA-N
ID: 92820
SMILES:CC1(C)Oc2c(c(O)c3c(c21)C=CC(C)(CCC=C(CCC=C(C)C)C)O3)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.158
InChIKey:LOSPECKSKUUMJE-UHFFFAOYSA-N