ID: 42526
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.401
InChIKey:IQFBDTWPFXQKNC-UHFFFAOYSA-N
ID: 42527
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 42528
SMILES:C(C1CC(C(C)C)C(c2c(O)cc(CCCC)cc2O)CC1C)CC=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -15.142
InChIKey:HLMRGMMBRXHHQG-UHFFFAOYSA-N
ID: 42529
SMILES:CC1(CC(CC(O)(C)C)OC2C(O)C(O)C(C)(C)O2)Oc2cc(O)c(=O)cc(C)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.517
CB1 binding score: -16.015
InChIKey:CEEJJEQBUBRYNM-UHFFFAOYSA-N
ID: 42530
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.388
InChIKey:XRSKTHYTMPGBSV-UHFFFAOYSA-N
ID: 42531
SMILES:C(c1cc(C(O)=O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -12
InChIKey:PXJMZGXVYVKUKH-UHFFFAOYSA-N
ID: 42532
SMILES:C1(=C)CCC2C(CO)(C)C3C1c1c(cc(CCCCC)cc1O2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.897
InChIKey:CHAMZEIJQHMOEM-UHFFFAOYSA-N
ID: 42533
SMILES:C1=C(C)CCC2C1c1c(c3c(O)c(C(C)C)cc(O)c31)Oc1c(ccc(CCC(C(O)=O)(O)C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.649
CB1 binding score: Not available
InChIKey:OGCOUIIOJJLHGC-UHFFFAOYSA-N
ID: 42534
SMILES:c1(C(C)CCCCC)cc(O)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.279
InChIKey:KILYGTSAOGPBJQ-UHFFFAOYSA-N
ID: 42535
SMILES:c1(CCCCC)cc(O)c(C=O)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -18.325
InChIKey:RVMHTORVNNTJSC-UHFFFAOYSA-N
ID: 42536
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 42537
SMILES:c1(O)c(CCCCC)c(C(O)=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -12.908
InChIKey:FQNVVAWYEQGKKG-UHFFFAOYSA-N
ID: 42538
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(cc(C)cc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.589
InChIKey:ILPMEUDSBVWXIW-UHFFFAOYSA-N
ID: 42539
SMILES:O=C(O)C(C)CCc1c2c(ccc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.808
InChIKey:FUKBYHFMLGSBHS-UHFFFAOYSA-N
ID: 42540
SMILES:CC(C1CC(=O)C(C)=CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N
ID: 42541
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 42542
SMILES:CC(C1OC(C(=CCCC(=CCc2cc(OC)cc(C)c2O)C)C)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.573
InChIKey:HRNQVRCPBZHJHE-UHFFFAOYSA-N
ID: 42543
SMILES:c1(C)cc2c(cc1)C(C)(C)Oc1c(c(OC)cc(CCCCCCCCC3CC(CNC)C3)c1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 479.705
CB1 binding score: -16.502
InChIKey:AWQQOANTCCVAJK-UHFFFAOYSA-N
ID: 42544
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)CCC=C(C)C)C)c(O)c1)c1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 42545
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)C=CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.766
InChIKey:MMPDVTGTYUAIBD-UHFFFAOYSA-N
ID: 42546
SMILES:c1(C(=N)O)ccc(O)c2c1OC(C)(C)C1CCC(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 275.304
CB1 binding score: -16.501
InChIKey:SWXSXMRUVBUHAB-UHFFFAOYSA-N