ID: 32383
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 32384
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(O)C(C)(C)Oc2ccc(O)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.231
InChIKey:DIXMUSLXMNWYKP-UHFFFAOYSA-N
ID: 32385
SMILES:CC(=CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(=O)C21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 326.436
CB1 binding score: -16.546
InChIKey:NUWRGLDRDHMNBO-UHFFFAOYSA-N
ID: 32386
SMILES:c1(CC(C)C)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.506
InChIKey:LCWPGHYENVNAJV-UHFFFAOYSA-N
ID: 32387
SMILES:C1(C(CCC=C(C)C)C)c2c(c(O)cc(CCCCC)c2)C2C(O)(C1)C(=O)c1c(cccc1)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: -15.204
InChIKey:WJJFCJNRFFDTJZ-UHFFFAOYSA-N
ID: 32388
SMILES:Oc1c2c3c(cc1)OC(C)(C)C1CCC(C)=CCC1(C3)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.908
InChIKey:FTTFTCQLFQQDMG-UHFFFAOYSA-N
ID: 32389
SMILES:c1c(C)ccc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 32390
SMILES:c1(CCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 270.416
CB1 binding score: -14.515
InChIKey:PKGPJCHTKLRWEN-UHFFFAOYSA-N
ID: 32391
SMILES:COc1cc(CCCCC)cc2c1C1=C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.347
InChIKey:LADCAKDPLOYEIO-UHFFFAOYSA-N
ID: 32392
SMILES:C1(C)(C)C(Cc2c(O)cc(CCCCC)c(C(=O)O)c2O)C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.702
InChIKey:QQDAMKLFMIMOTM-UHFFFAOYSA-N
ID: 32393
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 32394
SMILES:C1(OC)=CC(=O)c2c3c(c(OC)c(C(=O)C(C)C)c2)OC(C)(C)C2CCC(C)(O)C(C12)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -15.227
InChIKey:LFKRTQCAIOGCPJ-UHFFFAOYSA-N
ID: 32395
SMILES:C12C(C)(C)Oc3c(c(O)cc(C)c3)C1C(O)(C(=C)CC)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.407
InChIKey:ZYDUTSOGYBMCAB-UHFFFAOYSA-N
ID: 32396
SMILES:C(C(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.92
InChIKey:RNRKEZNENGNKPU-UHFFFAOYSA-N
ID: 32397
SMILES:OC(C1(CC=C(C)C)Cc2c(O)cc(CCCCC)cc21)C=CC=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -11.33
InChIKey:IZWUUXAYVSJLET-UHFFFAOYSA-N
ID: 32398
SMILES:C1c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(COC3C(O)C(O)C(O)C(CO)O3)(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.679
CB1 binding score: -16.32
InChIKey:ZWFAMPKILGWLGL-UHFFFAOYSA-N
ID: 32399
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32400
SMILES:c1cc(CO)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.903
InChIKey:WWPSWIHHPUFZBD-UHFFFAOYSA-N
ID: 32401
SMILES:C(c1ccccc1)(OC1C23C(C)C(O)CC2(C(C)(C)O1)C1C(C)(C2(O)C(C3)Oc3c2c(O)cc(CCCCC)c3)C1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.73
CB1 binding score: -14.808
InChIKey:KMSFFVBITGYKGW-UHFFFAOYSA-N
ID: 32402
SMILES:Oc1cc(CCCC)cc2c1C1(O2)C(C)(O)C=CC2C1CCC(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.605
InChIKey:TZGOUECLDKVARJ-UHFFFAOYSA-N
ID: 32403
SMILES:C(CC)CCCc1c(O)cc2c(c1O)C1C(C(C)(C)O2)CC=C(COC(C(C)=CC)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -16.395
InChIKey:IXEHERZTJREUSI-UHFFFAOYSA-N