ID: 93682
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.385
InChIKey:OEDPJGVWHANUAE-UHFFFAOYSA-N
ID: 93683
SMILES:C1(Br)C(C)(C)Oc2c(c(O)cc(CCCCC)c2Br)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.157
CB1 binding score: -15.374
InChIKey:CZRVVVXCBWGWBQ-UHFFFAOYSA-N
ID: 93684
SMILES:C1Oc2cc(CCCCC)c(C(=O)O)c(O)c2C1C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.994
InChIKey:VOBBSPVAVTXROL-UHFFFAOYSA-N
ID: 93685
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CCC(C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.813
InChIKey:RVYIYNAHZIOZEG-UHFFFAOYSA-N
ID: 93686
SMILES:CC1=C2Oc3c(c(OC(=O)C)cc(CCC)c3)C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.308
InChIKey:NFLQEUDKTFSYMQ-UHFFFAOYSA-N
ID: 93687
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.433
InChIKey:PQJHNORQVFURSH-UHFFFAOYSA-N
ID: 93688
SMILES:C(=O)(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)C(O)C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -14.494
InChIKey:GBDGCUMQAPHLPU-UHFFFAOYSA-N
ID: 93689
SMILES:C12(C(=O)Oc3ccccc3)C(OC(=O)C)C(OC(CCCC)=O)CC(C)(C)C1Cc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 580.718
CB1 binding score: -14.715
InChIKey:MDQYGRSXLWXLEN-UHFFFAOYSA-N
ID: 93690
SMILES:C(C1(C)C=Cc2c(ccc(O)c2)O1)C=CC(OC(C)(C)C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.374
InChIKey:JNRLZRUKTJAZAB-UHFFFAOYSA-N
ID: 93691
SMILES:CC1(C)CCCC2COC3=C4C(C(C)C32O1)Oc1c(c(OC)cc(C(C)C(O)C)c1)C4
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.929
InChIKey:KYVJQZJKIQEKFA-UHFFFAOYSA-N
ID: 93692
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(O)(O2)C(C)(C)C(=O)C(C)(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.897
InChIKey:RFODBPKDJMAZQO-UHFFFAOYSA-N
ID: 93693
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCC)c(C(=O)O)c1O)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.506
InChIKey:HCMUWUZVPRJXHT-UHFFFAOYSA-N
ID: 93694
SMILES:C(c1c(O)cc(O)c2c1OC(CCC=C(C)C)(C)C(O)C2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -16.527
InChIKey:KQRGDLFBKGAOAK-UHFFFAOYSA-N
ID: 93695
SMILES:Cc1cc2c(cc1O)C(C)(C)Oc1c(c(O)cc(CCCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.929
InChIKey:COVYMYSCGNFENA-UHFFFAOYSA-N
ID: 93696
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(CO)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.324
InChIKey:NRUNPFJCAWCDJM-UHFFFAOYSA-N
ID: 93697
SMILES:C(C1(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(C(C)=C)CC2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.142
InChIKey:BPZCDIWICGDSKC-UHFFFAOYSA-N
ID: 93698
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C3(O2)OC2(C1)C(C3)CC(O2)C(CCC=C(CO)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -11.324
InChIKey:LETBDIPDHRTBIG-UHFFFAOYSA-N
ID: 93699
SMILES:OC(c1cc(OC)c2c(c1O)OC(C)(C)C1CC=C(C)CC12)C(O)C(O)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.464
CB1 binding score: -16.379
InChIKey:ACBGJUAYZJBLIY-UHFFFAOYSA-N
ID: 93700
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.979
InChIKey:RPIAMKIGKMZKPE-UHFFFAOYSA-N
ID: 93701
SMILES:C1(Cc2ccccc2O)C2CC(C)CCC2C(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.099
InChIKey:SZZIMHNELDTZDN-UHFFFAOYSA-N
ID: 93702
SMILES:C1C(O)(C)C(O)C2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N