ID: 51451
SMILES:C1CC(C)(C)C2C3C(C)(Oc4cc(CCCCC)c(OC(=O)C)c(c43)O1)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.735
InChIKey:XSJPOMMFAAAGOY-UHFFFAOYSA-N
ID: 51452
SMILES:CC(=CCCC(C)(O)C1Oc2c(c(O)cc(CCCC)c2)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.489
InChIKey:BVRCFSFDJSSFCE-UHFFFAOYSA-N
ID: 51453
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.98
InChIKey:DALAPULHEYBQAX-UHFFFAOYSA-N
ID: 51454
SMILES:O(C1C(O)C(O)C(O)C(CO)O1)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.474
CB1 binding score: -17.196
InChIKey:GWPVNIPGGOIRAO-UHFFFAOYSA-N
ID: 51455
SMILES:O1C(CCCC(C)=C)(C)C=Cc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.538
InChIKey:REZCDQVMWOXQBZ-UHFFFAOYSA-N
ID: 51456
SMILES:C1=C(C)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 51457
SMILES:C(CCC)c1c(O)cc2c(c1O)C1C(C(C)(C)O2)CCc2c1cc(CC=C(C)C)cc2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -15.597
InChIKey:BPSMEYKEDDNDPD-UHFFFAOYSA-N
ID: 51458
SMILES:C1C(C)=CC2c3c(cc(CCCCC)c(OC)c3)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.982
InChIKey:GLUWKBFJPNDEDK-UHFFFAOYSA-N
ID: 51459
SMILES:C1(C)(O)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -19.298
InChIKey:MQXCBGKFCUXOIM-UHFFFAOYSA-N
ID: 51460
SMILES:Cc1cc2c(c(O)c1)C1CC(C)(CC=C1C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.778
InChIKey:CKFKXPUZEIEQJR-UHFFFAOYSA-N
ID: 51461
SMILES:C(C(=O)C1=Cc2c(cc(CCCCC)cc2O)OC1(C)CCC=C(C)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.359
InChIKey:CYLNUNBEHPIUOM-UHFFFAOYSA-N
ID: 51462
SMILES:C12(Oc3c(c(O)cc(CCCC)c3)C1O)C(O)C(O)C(C)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -15.334
InChIKey:SHFQXOIQGLEEEK-UHFFFAOYSA-N
ID: 51463
SMILES:CC(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 51464
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 51465
SMILES:c1(CCCCC)cc2c(c(O)c1CC=C(C)C)OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.521
InChIKey:SIIPISVAQMOEHT-UHFFFAOYSA-N
ID: 51466
SMILES:C1(C)(NC=O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 359.51
CB1 binding score: -15.766
InChIKey:DDCYYHZBCYVFEI-UHFFFAOYSA-N
ID: 51467
SMILES:C(C1=C(C)OC(C)(C)C2CCC(C)=CC12)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.448
CB1 binding score: Not available
InChIKey:JPGAADSASAZQMK-UHFFFAOYSA-N
ID: 51468
SMILES:O(c1cc(CCCC)ccc1O)C1C2C(CCCC2(CC(C=C(C)C)=O)C)CC(C)(O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.55
InChIKey:QBNUACUQRWGQEM-UHFFFAOYSA-N
ID: 51469
SMILES:CC(C)=CCc1c(-c2ccccc2)cc2c3c1OC(C)(C)C1CCC(C)=CC1C(O3)C2C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.654
CB1 binding score: -15.519
InChIKey:NIWFSIJQIRVQFQ-UHFFFAOYSA-N
ID: 51470
SMILES:CCCC1C2C(CC1O)c1c(c3c(cc(CCCCC)cc3O)OC2(C)C)OC(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -17.452
InChIKey:MFPPOGOFLINCKU-UHFFFAOYSA-N
ID: 51471
SMILES:C1(=O)C=C2C(C)(CCC(O)C2(C)C)Oc2c(c(O)cc(CCCCC)c2)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.901
InChIKey:RDLBRFHKHLQZIE-UHFFFAOYSA-N