ID: 31102
SMILES:CC(C)(C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.969
InChIKey:NPPHBVFNDGBAJA-UHFFFAOYSA-N
ID: 31103
SMILES:C1(=C)CC2C(C(C)(C)Oc3cc(C)ccc32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -15.929
InChIKey:OCORFTQXHOMHDM-UHFFFAOYSA-N
ID: 31104
SMILES:c1(O)cc(CCCC)cc2c1OC(C)(CCC=C(C)C)C(O)(C=CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.141
InChIKey:IJWUEQKVGQGDTR-UHFFFAOYSA-N
ID: 31105
SMILES:C1=Cc2c(c(C(O)=O)c(CCCCC)cc2O)OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -17.796
InChIKey:JRDXSDYHHLODOB-UHFFFAOYSA-N
ID: 31106
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)(O2)CC2C1(C)CC1(O)C(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.581
InChIKey:HPDLLALUFZAHPH-UHFFFAOYSA-N
ID: 31107
SMILES:Oc1c(CCCCC)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N
ID: 31108
SMILES:C(CCC(OC)=O)c1cc(C2C(C(C)=C)CCC(C)=C2)c(O)c(C(O)=O)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -13.838
InChIKey:NVLYTQQIRUWBSN-UHFFFAOYSA-N
ID: 31109
SMILES:C(=CCCC(C)=CCc1cc(O)c(C)cc1OC(=O)C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.332
InChIKey:HAXRQCRJABYNJC-UHFFFAOYSA-N
ID: 31110
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.083
InChIKey:AYMRREFEEFYHLH-UHFFFAOYSA-N
ID: 31111
SMILES:C(C)(C)C1CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.015
InChIKey:PNGZLIGTJPGAIU-UHFFFAOYSA-N
ID: 31112
SMILES:C(CCC)=Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.334
InChIKey:HJRYMUQWODLWCL-UHFFFAOYSA-N
ID: 31113
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 31114
SMILES:C1(CO)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 31115
SMILES:C1(C)(C)C2C3C(=O)C4(C(C)C(C(C)=CCC4)Oc4c3c(cc(C(C)C)c4)O1)C(=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -11.985
InChIKey:RCOLGQWDPSDSOS-UHFFFAOYSA-N
ID: 31116
SMILES:C(CCCc1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1)C=Cc1cc(OC)c(OCC=C(C)CCC=C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.842
CB1 binding score: -13.573
InChIKey:MTBCIWUISFTZSV-UHFFFAOYSA-N
ID: 31117
SMILES:C(C)CCCCc1cc2c(c(O)c1)OC(CCC1(C)C(C)(C)Oc3c1cc(OC)c(O)c3)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -15.686
InChIKey:RLOOQEVWZFFEPZ-UHFFFAOYSA-N
ID: 31118
SMILES:C1(C(C)C)(O)C(c2c(O)cc(CCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.739
InChIKey:SMQUWESTQWGQOK-UHFFFAOYSA-N
ID: 31119
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(=C)C)CC(O)C(C)=C1C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -13.704
InChIKey:KYLIFAMKICDTBB-UHFFFAOYSA-N
ID: 31120
SMILES:CC1(C)C2C(C3(C)Oc4c(c(O)cc(CCCCC)c4)C3C=C(C)CCC=C(C)CC2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: Not available
InChIKey:DMPOMRUXCCUCSY-UHFFFAOYSA-N
ID: 31121
SMILES:CC1(C)Oc2cc(CCC)cc(O)c2C2C1C(O)CC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.818
InChIKey:QCKYYBZSHSLBFY-UHFFFAOYSA-N
ID: 31122
SMILES:C1C(=O)C2C(c3c(O)cc(CCCCC)cc3O1)C(C(C)=C)CC(O)C2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.98
InChIKey:MVXOLUKMVFNUBF-UHFFFAOYSA-N