ID: 40027
SMILES:C=CCCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -15.818
InChIKey:NZTOPHXPMBJDIB-UHFFFAOYSA-N
ID: 40028
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 40029
SMILES:CC1(C)C2CC3=C(C(=O)C2(C(=O)C(C)C)C(C)=CC(C(C)=C)C3)C(c2ccc(O)cc2)CC(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -14.06
InChIKey:GXMFLXJNIOGUMU-UHFFFAOYSA-N
ID: 40030
SMILES:C(c1c(O)c2c(cc1CCCCC)OCO2)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.556
InChIKey:LAQDJBTYYQLBES-UHFFFAOYSA-N
ID: 40031
SMILES:C(C)(=O)OC1CC2=C(CC(C)C2)C(C)(C)Oc2cc(CCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.64
InChIKey:XBJGSZJMPZUKOE-UHFFFAOYSA-N
ID: 40032
SMILES:CC(=CCCC1(C)C(O)Cc2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 40033
SMILES:CCCCCCc1cc2c3c(c1)OC(C)(C)C1CC=C(C)CC3CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.968
InChIKey:KDOQRYFWOYSPRO-UHFFFAOYSA-N
ID: 40034
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2(C)CCC12C3C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.837
InChIKey:YADXCODQNHCGQA-UHFFFAOYSA-N
ID: 40035
SMILES:c1(O)c(C(=O)C)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.944
InChIKey:YPIZGFLNQQXMNW-UHFFFAOYSA-N
ID: 40036
SMILES:CC12CCCC(C)=C1Cc1c(O)cc(CCCCC)c(C(=O)O)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.855
InChIKey:JUIILEKWJBDCJN-UHFFFAOYSA-N
ID: 40037
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 40038
SMILES:C1CC(C)c2c(C=O)c(CCCCC)cc(OC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -13.401
InChIKey:HZVXWWPRPXWEPH-UHFFFAOYSA-N
ID: 40039
SMILES:C(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 40040
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 40041
SMILES:C1(C)c2c(cc(C)c(O)c2)-c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.197
InChIKey:OHDXBYOMIKYWHS-UHFFFAOYSA-N
ID: 40042
SMILES:c12c(cc(CCCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 40043
SMILES:C(Cc1c(CC=C(C)C)c2c(c(C(=O)C(CC)C)c1O)OC(C)(C)C1CC=C(C)CC12)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.723
CB1 binding score: -14.144
InChIKey:IGAHYUYVKZTPOY-UHFFFAOYSA-N
ID: 40044
SMILES:C(c1cc(O)c(C2C(C)=CCC(CCC3CC3C)C2C(OC)=O)cc1)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.929
InChIKey:YNSLAUCFBRVHRL-UHFFFAOYSA-N
ID: 40045
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)c1c2CCC(O)(C)C1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.414
InChIKey:CNPRCQFLMMAYHU-UHFFFAOYSA-N
ID: 40046
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 40047
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N