ID: 88096
SMILES:C1=Cc2c(cc(CCCCC)c(C(=O)O)c2O)OC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 88097
SMILES:CC1(C)C2CCC(C)=CC2c2c(c(CCC(CC)O)co2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.062
InChIKey:ZDZMRQCMZPNPSJ-UHFFFAOYSA-N
ID: 88098
SMILES:C1C2C(C)(C)Oc3c(ccc(CCCCC)c3O)C2CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.801
InChIKey:UWATVNJFNTWDFT-UHFFFAOYSA-N
ID: 88099
SMILES:C1(C)(O)C=C2C(O)(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.692
InChIKey:ABAIQGZTVAZSBJ-UHFFFAOYSA-N
ID: 88100
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C(O)CC(C)=CCCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.628
InChIKey:VERDKUOGGGDVRX-UHFFFAOYSA-N
ID: 88101
SMILES:CN(C(C)=C)C1C2CC=C(C)C2Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 355.522
CB1 binding score: -16.386
InChIKey:URGYZDPLJOTPPB-UHFFFAOYSA-N
ID: 88102
SMILES:C1CC2C(C)(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3O)C2C2C(C)CCC2C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -14.449
InChIKey:UEEBCFNXIWQZCM-UHFFFAOYSA-N
ID: 88103
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C(=O)O)CCC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -17.58
InChIKey:JUCLDUBEEVHDFE-UHFFFAOYSA-N
ID: 88104
SMILES:C12C(C(=C(C)C)CCC1C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.672
InChIKey:KZQWSVVQNXRHOP-UHFFFAOYSA-N
ID: 88105
SMILES:OC12C(c3c(cc(CCCCC)cc3O)O1)CC1C(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -11.676
InChIKey:IMQFIXOUOPKJIA-UHFFFAOYSA-N
ID: 88106
SMILES:c1(OC)c(C2C(C(C)C)CCC(C)=C2)c(O)c(CC=C(C)CCC=C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.809
InChIKey:WBECIXXSYMBPAS-UHFFFAOYSA-N
ID: 88107
SMILES:CC(=O)Oc1c(C2C=C(C)CCC2C(=C)C)c(O)cc(CC=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.74
InChIKey:NOCXRXOOHBPIPK-UHFFFAOYSA-N
ID: 88108
SMILES:O=C1C(C)CCC2C(C)(O2)C2C3C1C(C)(C)Oc1cc(CCCCC)cc(c31)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -12.181
InChIKey:ZOKKBFOSAGNAJT-UHFFFAOYSA-N
ID: 88109
SMILES:C(C)CCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 88110
SMILES:c12c(c(OC)cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.807
InChIKey:GZHYVMBIOGXARC-UHFFFAOYSA-N
ID: 88111
SMILES:C1C2=C(CC(C)(C)Oc3c2c(O)cc(CCC)c3)C(=O)C2(C)CCC1(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.018
InChIKey:SJWPSBQXUDYIPC-UHFFFAOYSA-N
ID: 88112
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(O)c(Br)c(C)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -17.527
InChIKey:QBQQUYHSKCGBDI-UHFFFAOYSA-N
ID: 88113
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC3C1C2(C)CCC3(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.803
InChIKey:HQSVSYCGGQHLAO-UHFFFAOYSA-N
ID: 88114
SMILES:COc1cc(CCCCC)cc2c1C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.153
InChIKey:FHFWMWLGGRCLAF-UHFFFAOYSA-N
ID: 88115
SMILES:CC1CC(c2c(O)cc(CCCCC)cc2)OC(C=C(C)CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.813
InChIKey:QFSTXSLMSDQIDS-UHFFFAOYSA-N
ID: 88116
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)OC)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.703
InChIKey:ODGYRHKHFGCIRR-UHFFFAOYSA-N