ID: 55420
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(=C)C)CCC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.825
InChIKey:ZOQOWBOVOPMLPU-UHFFFAOYSA-N
ID: 55421
SMILES:c12cc(CCCCC)cc(O)c1c(C(O)=C)c(O)c(CC=C(C)CCC=C(C)C)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 424.581
CB1 binding score: -14.263
InChIKey:BONWETGNPQKIDJ-UHFFFAOYSA-N
ID: 55422
SMILES:C(Cc1c(OC(=O)c2ccccc2O)c2c(cc1)OC(C)(C)C1C2C=C(C)CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -15.835
InChIKey:PVRWWBLPXJJEFE-UHFFFAOYSA-N
ID: 55423
SMILES:C(O)C(C)=CCc1c(OC)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -17.429
InChIKey:OOAVWYOYGYEXHP-UHFFFAOYSA-N
ID: 55424
SMILES:C1C2C(C(C)(CO)Oc3cc(CCCCC)cc(O)c31)CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.257
InChIKey:GWOCFJJEFQIYGY-UHFFFAOYSA-N
ID: 55425
SMILES:C(CCc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.575
InChIKey:NXPNWMQZZRHKHX-UHFFFAOYSA-N
ID: 55426
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55427
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -18.138
InChIKey:CUNZWRHOBZASJY-UHFFFAOYSA-N
ID: 55428
SMILES:C12(O)C(C)(C)CCCC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.936
InChIKey:PQQRNCAZHIQNPU-UHFFFAOYSA-N
ID: 55429
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55430
SMILES:Oc1c(C(=O)C(CC)C)c2c(c(O)c1)C1C(C3CC(C(OC)=O)(C)CC3=C(C)C=C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.509
CB1 binding score: -13.499
InChIKey:BAIOVNXQKVALBM-UHFFFAOYSA-N
ID: 55431
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 55432
SMILES:c12c(c(O)c(CC=C(CCC=C(C)C)C)cc1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.912
InChIKey:DGFLJGUOJFHPFM-UHFFFAOYSA-N
ID: 55433
SMILES:c1(C(C)CC(=O)C)cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(O2)C3CC(C)(C)C1C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.354
InChIKey:WEEZDFMYCUVHEY-UHFFFAOYSA-N
ID: 55434
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C=O)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.465
InChIKey:VAHVQIKQDGAFDP-UHFFFAOYSA-N
ID: 55435
SMILES:C(CCCCCCC)c1c2c(c(O)c(C=O)c1O)C1C(=CCCC1C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.444
InChIKey:VGPFVCIRFXZWJI-UHFFFAOYSA-N
ID: 55436
SMILES:C(C)(C)=CCCC(C)=CCc1c(O)c(C(=O)OC)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 55437
SMILES:c1(O)c(Cl)c(CC=C(C)CCC=C(C)C)c(O)c(C(O)CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.875
CB1 binding score: -17.836
InChIKey:NUDMWOVEFGDONV-UHFFFAOYSA-N
ID: 55438
SMILES:c1cc(OC)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.764
InChIKey:NRRZXOLZVDIGDT-UHFFFAOYSA-N
ID: 55439
SMILES:COC(C(C)C)CCC(C)=CCCC1(C)C=Cc2c(cc(C)c(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.123
InChIKey:TXWGMZMKSILQAB-UHFFFAOYSA-N
ID: 55440
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.266
InChIKey:ITBJIGAFFZMQSY-UHFFFAOYSA-N