ID: 79108
SMILES:N(C1C=C(C)CCC1C(=C)C)c1cc(CCCc2ccccc2)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 415.665
CB1 binding score: -12.246
InChIKey:PAHVPEQSXSKIJN-UHFFFAOYSA-N
ID: 79109
SMILES:CC1(C)Oc2c(c(O)cc3c2OC(CCC=C(C)C)(C)C=C3)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.552
InChIKey:NPDIPGUEQNSHED-UHFFFAOYSA-N
ID: 79110
SMILES:c1(OC)cc(CCCCC)c2c(c1OC(C)=O)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -13.206
InChIKey:FGQRXCNWFJGSNE-UHFFFAOYSA-N
ID: 79111
SMILES:C1CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -16.111
InChIKey:RQWYVCGIIWOXBX-UHFFFAOYSA-N
ID: 79112
SMILES:C(C)(C)=CC1OC2=CC(O)(C)CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.929
InChIKey:LQNCQZWBLFWQBR-UHFFFAOYSA-N
ID: 79113
SMILES:CCCCCc1c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 79114
SMILES:c1(CCCCC)c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 79115
SMILES:c1(CCCCC)ccc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 79116
SMILES:C(c1ccc2c(c1)OC(C)(C)C(O)C2)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -12.638
InChIKey:QRZNRLJAJCPLKK-UHFFFAOYSA-N
ID: 79117
SMILES:C1C2C(C)(CCC(OC)C2(C)C)C(Cc2c(O)cc(CCCCC)c(OC)c2O)=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.656
CB1 binding score: -15.466
InChIKey:FYMHYYCBGKFFDH-UHFFFAOYSA-N
ID: 79118
SMILES:OC(c1c(CCCCCC)cc(CC=C(CCC=C(C)C)C)c(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.347
InChIKey:OUALIDMHXQRNHM-UHFFFAOYSA-N
ID: 79119
SMILES:O=C(CC1(C)Oc2cc(O)cc(O)c2C2C1CCC(C)=C2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -12.652
InChIKey:ZNRHQLGJHPPTAZ-UHFFFAOYSA-N
ID: 79120
SMILES:C12C(C=C(C)C1C)c1c(cc(C)c(C(=O)O)c1C)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.115
InChIKey:JCSTWPXSRPKPCK-UHFFFAOYSA-N
ID: 79121
SMILES:CC(C1=CCC2(C)CC1c1c2c(OC)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -12.387
InChIKey:URCTXECJPKRCHY-UHFFFAOYSA-N
ID: 79122
SMILES:O=C(C)OC1(C(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)c(Cl)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.966
CB1 binding score: -14.762
InChIKey:KUSIAGGQUHKLTG-UHFFFAOYSA-N
ID: 79123
SMILES:c1(O)cc(CCCCC)cc2c1-c1cc(C)cc(O)c1CC2C(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -13.859
InChIKey:BSRZFKGFLIHCQY-UHFFFAOYSA-N
ID: 79124
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.293
InChIKey:WAIFYTFDDBLEDM-UHFFFAOYSA-N
ID: 79125
SMILES:c1(OC)cc2c(cc1CC)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.015
InChIKey:LANGAAXHCWIKOQ-UHFFFAOYSA-N
ID: 79126
SMILES:c1(CCCCC)cc2c3c(c1O)OC(C)(C)C1C3C(O2)C(C)(O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.654
InChIKey:KWWUTQQFPGMRMK-UHFFFAOYSA-N
ID: 79127
SMILES:C(CCCC)c1cc(O)c2c(c1O)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.533
InChIKey:MBXAIRIUNYLGKW-UHFFFAOYSA-N
ID: 79128
SMILES:C(c1cc(O)c2c3c(ccc(C)c31)OC(C)(C)C1CCC2C1=O)C(CO)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.258
InChIKey:CHRAQQRDPCSNNV-UHFFFAOYSA-N