ID: 78016
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCCC)cc3O1)C(=O)C(C)=C(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.144
InChIKey:BCAMFVDXYSKLDW-UHFFFAOYSA-N
ID: 78017
SMILES:O1c2c(O)cc(CCCCC)cc2C2C=C(CC=C1C)C(=O)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -13.932
InChIKey:FYUPQGGIHMVJAZ-UHFFFAOYSA-N
ID: 78018
SMILES:BrC1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)CCC2C(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.473
CB1 binding score: -15.929
InChIKey:ZORXPYMCODAUSU-UHFFFAOYSA-N
ID: 78019
SMILES:Oc1c(C(C)(C)C)c(O)cc2c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.421
InChIKey:BYCICOQPSFVXTK-UHFFFAOYSA-N
ID: 78020
SMILES:C1(C(=O)O)=CC2C(C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.604
InChIKey:XHRDSUURZXJLCT-UHFFFAOYSA-N
ID: 78021
SMILES:O(C)c1cc(CCCC)cc2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.546
InChIKey:BKDVCSXBNXBCEJ-UHFFFAOYSA-N
ID: 78022
SMILES:O(c1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.527
InChIKey:YGXCEHMXNYVYKF-UHFFFAOYSA-N
ID: 78023
SMILES:c12c(O)cc(CCC)cc1OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 78024
SMILES:OCC1=CC2c3c(cc(O)c(CC=C(C)CCC=C(C)C)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -17.193
InChIKey:JGNTYHQPNRHJSD-UHFFFAOYSA-N
ID: 78025
SMILES:Oc1cc(CCCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 78026
SMILES:C12=C3C4C(OC(C)C(C)(OCC1O)OC42)c1c(cc(CCCCC)cc1O)OC3O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.486
CB1 binding score: -13.551
InChIKey:UQDPPTALNGKMFW-UHFFFAOYSA-N
ID: 78027
SMILES:C(=C(C)C)C=CC(C)C1Oc2c(c(O)cc(CCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.271
InChIKey:RQJCKJVIOAKUHG-UHFFFAOYSA-N
ID: 78028
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 78029
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1=O)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.176
InChIKey:FCVQNHMDNIVVNL-UHFFFAOYSA-N
ID: 78030
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 78031
SMILES:C1=C(C)CC2c3c(O)cc(C(C)C=C(CCCCC)C)c(O)c3C(=O)C(C)=C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.521
InChIKey:VJRXMRAUZRVOEN-UHFFFAOYSA-N
ID: 78032
SMILES:Oc1c(C(C(CC)C)=O)cc(C2C(C(C)=C)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.051
InChIKey:QYJIKRRZJPWZHH-UHFFFAOYSA-N
ID: 78033
SMILES:CCCCCc1cc(O)c(C2C=C(CCC(C(C)=C)O)C(=O)O2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -9.63
InChIKey:UDXBUOUSAFMSOF-UHFFFAOYSA-N
ID: 78034
SMILES:O1c2c(c3c(cc(CCCCC)cc3O)OC(C)(C)C2)CC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: Not available
InChIKey:ZPEGTUMLWVKQSX-UHFFFAOYSA-N
ID: 78035
SMILES:c1(C2C(C(C)=C)C(c3cc(CCCCC)cc(OC)c3)CC2(C)CCC=C(C)C)c(O)cc(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -15.928
InChIKey:VSORMMVDLDSQRV-UHFFFAOYSA-N
ID: 78036
SMILES:C12(CO)c3c(O)cc(CCCCC)cc3OC(C)(C)C1=CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -12.678
InChIKey:GTLVJQBMOKPKJF-UHFFFAOYSA-N