ID: 128836
SMILES:C1(=C(C)C)CC2C(C)(Oc3cc(CCCCC)cc(O)c3C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.824
InChIKey:PNHKKTIVHUYYGC-UHFFFAOYSA-N
ID: 128837
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 128838
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CC=C(C)CCC1=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.492
InChIKey:PZRZRHVVAAJSFU-UHFFFAOYSA-N
ID: 128839
SMILES:C1c2c(O)cc(CCC)cc2OC2(C)OCC(C)(O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -15.51
InChIKey:PQMOFZUOWMDOKK-UHFFFAOYSA-N
ID: 128840
SMILES:c1c(=O)c(O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.746
InChIKey:PNRXQGWMOWKAAG-UHFFFAOYSA-N
ID: 128841
SMILES:c1(C)ccc2c(c1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -16.089
InChIKey:IGOPUCGVGYDCFW-UHFFFAOYSA-N
ID: 128842
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)cc(CC(=O)C(C)(C)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.533
InChIKey:DJRDXXQTZGBDFS-UHFFFAOYSA-N
ID: 128843
SMILES:c1(CCCCC)cc2c(c(O)c1C1C(C(C)=C)CCC(C)=C1)C=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -14.576
InChIKey:BBRQDDIZRXYHAI-UHFFFAOYSA-N
ID: 128844
SMILES:C12CCC(C)=CC1c1c(O)cc(CCCCCO)cc1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.825
InChIKey:DDKUOTYDJKJCRV-UHFFFAOYSA-N
ID: 128845
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C(CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.824
InChIKey:INTNPSTYODPHGD-UHFFFAOYSA-N
ID: 128846
SMILES:C1(=O)c2c(CCCCC)ccc(O)c2CCC1(CC1C(C)(C)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.636
InChIKey:IPVVXIDGJILSFD-UHFFFAOYSA-N
ID: 128847
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC2(COC(c3c(O)cc(C=O)c(C(=O)OC)c3)C(c3ccccc3)=O)CCC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 654.8
CB1 binding score: -14.235
InChIKey:IELVLJFBHFHINK-UHFFFAOYSA-N
ID: 128848
SMILES:c1c(O)cc(OC)cc1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.469
InChIKey:GRAZENHLNPSWRA-UHFFFAOYSA-N
ID: 128849
SMILES:O=C1OC(CC2(C)CCc3c(cc(CCCCC)cc3O)O2)C(C)=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.842
InChIKey:MYTIPAICHDIWPG-UHFFFAOYSA-N
ID: 128850
SMILES:c1c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 272.432
CB1 binding score: -19.328
InChIKey:YHUODCAWVDJHGS-UHFFFAOYSA-N
ID: 128851
SMILES:c1(CC(C)C)cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.868
InChIKey:CJHDLPIPPSHNLG-UHFFFAOYSA-N
ID: 128852
SMILES:C(C1CCC(C)=CC1c1c(O)cc(O)cc1C)(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 128853
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 128854
SMILES:C1CC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 128855
SMILES:C1C(C(C)C)C(c2c(O)cc(CCC)cc2OC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.172
InChIKey:ZLMHDSKDPRIBDQ-UHFFFAOYSA-N
ID: 128856
SMILES:COc1c(OC)c(OC)cc2c1C1C(C(C)(C)Oc3ccc(C(OC)=O)cc31)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -14.485
InChIKey:SMFRCPDVOISJLD-UHFFFAOYSA-N