ID: 40510
SMILES:c1(CC=C(C)CC(O)C(=O)C(=C)C)c2c3c(cccc3o1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -16.575
InChIKey:ULDXWKNSZMWGFM-UHFFFAOYSA-N
ID: 40511
SMILES:O=C(c1cc2c(c(O)c1)OC1(O)C3(CC3C(C)=C)CCC1C(C)(C)O2)NCCN(CC)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.599
CB1 binding score: -16.881
InChIKey:OPAREDKBOMGWKI-UHFFFAOYSA-N
ID: 40512
SMILES:O=C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC21)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.291
InChIKey:YDBGKHIABGUVIR-UHFFFAOYSA-N
ID: 40513
SMILES:c1(C(C)=O)cc2c(cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -18.637
InChIKey:CSSBWYMQRRNADD-UHFFFAOYSA-N
ID: 40514
SMILES:c12c(O)cc(OC)cc1OC(C)(C)C1CC=C(C)CC1(O)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.141
InChIKey:CFOWPTAVWGWWBW-UHFFFAOYSA-N
ID: 40515
SMILES:C(CCCc1ccc(O)c(CC=C(C)CCC=C(C)C)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N
ID: 40516
SMILES:C12c3c(cc(CCCCC)o3)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.496
InChIKey:YFDZZYBMGPHHKQ-UHFFFAOYSA-N
ID: 40517
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(=C1)C(C)(C)C(Cl)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.886
CB1 binding score: -15.289
InChIKey:FOLRVHUBZPVUBY-UHFFFAOYSA-N
ID: 40518
SMILES:C12=C(C(C)CCC=C1C)c1c(O)cc(C)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.539
InChIKey:HWSUOSBULLVPSR-UHFFFAOYSA-N
ID: 40519
SMILES:C(CC)Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -13.305
InChIKey:MEAZSYGABHIRDM-UHFFFAOYSA-N
ID: 40520
SMILES:c12c(ccc(CCCCC)c1)C1(Oc3c(c(C=O)cc(C(O)C(C)C)c3)C1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -13.842
InChIKey:YQJPUAPFJPLOLG-UHFFFAOYSA-N
ID: 40521
SMILES:C1=CC(C)(C)Oc2c1c(O)c(CCCCC)c(O)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.563
InChIKey:WRCCJTCQYAIISY-UHFFFAOYSA-N
ID: 40522
SMILES:C1CC(C(=O)O)C2C3(C(C(C)(C)Oc4cc(CCCCC)cc(O)c43)CC2)C1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -12.396
InChIKey:KGBYLEZNUYTBBV-UHFFFAOYSA-N
ID: 40523
SMILES:CC(=CCCC(C)=CCCC1(C)C2CCC(C)=CC2c2c(c(O)ccc2O)O1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.442
InChIKey:LVACXELDGFIZBV-UHFFFAOYSA-N
ID: 40524
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.269
InChIKey:SEZYEGYUECNXNK-UHFFFAOYSA-N
ID: 40525
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC=C(CO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.608
InChIKey:HUDBWDLEGNYKJY-UHFFFAOYSA-N
ID: 40526
SMILES:C(C1=CC2C(C(C)(C)Oc3c(C(C)C(CC)O)cc(O)cc32)CC1)(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.513
InChIKey:MZANGVFJJQRTRL-UHFFFAOYSA-N
ID: 40527
SMILES:C1C=C(C)C(=O)C(OC(=O)C)C(C(C)C)=CC=C(C)CC2c3c(c(CCCCC)cc(O)c3)OC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -15.588
InChIKey:UQXDUAGYALOTPH-UHFFFAOYSA-N
ID: 40528
SMILES:CCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 40529
SMILES:C1CC(C(=O)O)CC(O)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -12.3
InChIKey:HGDVKDBOAQZRMX-UHFFFAOYSA-N
ID: 40530
SMILES:C(CCCC)c1cc(O)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N