ID: 100612
SMILES:OC1C(C)=CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.808
InChIKey:CVJIVDZPIMCFSK-UHFFFAOYSA-N
ID: 100613
SMILES:c1(C)cc2c(cc1Br)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.333
CB1 binding score: -16.681
InChIKey:OTKPDAYTNFKOLH-UHFFFAOYSA-N
ID: 100614
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 100615
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.479
InChIKey:LBIQTJYHOQJYJR-UHFFFAOYSA-N
ID: 100616
SMILES:C1(O)C2CCC(C)C2C2=C(C(C)(C)Oc3cc(CCCCC)cc(c32)CC=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -16.966
InChIKey:BFNOENLYPIFQAL-UHFFFAOYSA-N
ID: 100617
SMILES:C(CN(C)CC(=CO)C)c1c(O)c(C(=O)CCCCC)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 469.666
CB1 binding score: -15.519
InChIKey:APXWJUZHKUISNH-UHFFFAOYSA-N
ID: 100618
SMILES:C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12)C(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -13.703
InChIKey:BXHJCINTTIKREG-UHFFFAOYSA-N
ID: 100619
SMILES:Fc1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.324
CB1 binding score: -14.451
InChIKey:KRRMVNLGFHSION-UHFFFAOYSA-N
ID: 100620
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 100621
SMILES:C(CCC=C(CCC=C(C)C)C)(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 100622
SMILES:Oc1c(C2C(C(O)(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 100623
SMILES:C1C2C(CCC1(C)OOC(C)(C)C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.591
CB1 binding score: -15.288
InChIKey:SZPOGTHDPGFVTR-UHFFFAOYSA-N
ID: 100624
SMILES:O=C(C(C)C)OCC(c1c(O)c2c(cc1)OC(C)(C)C1C2CC(C)=CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -17.495
InChIKey:DQCPFFXCIRXKEH-UHFFFAOYSA-N
ID: 100625
SMILES:C12C(CC(C)=CC1)c1c(cccc1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.418
InChIKey:UEUDZYHJJLDGIZ-UHFFFAOYSA-N
ID: 100626
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 100627
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 100628
SMILES:C12CC(C(C)(C)O)CCC1(C)Oc1c2c(O)cc(CCCCC)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.498
InChIKey:VGFKDQIIIHXWSD-UHFFFAOYSA-N
ID: 100629
SMILES:c1c2c(c(CCCCC)cc1)OC(C)(C)C21Cc2c(cc(C(=O)O)c(C)c2)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.495
CB1 binding score: -14.07
InChIKey:SYUDKYUIFRZYEA-UHFFFAOYSA-N
ID: 100630
SMILES:C(C)c1c(O)cc2c(c1)C1C3=C(C)C=CC(=C3C)CCC(C)(Oc3cc(CCCCC)cc(O)c31)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.707
CB1 binding score: -15.394
InChIKey:HBJYBROKDGTBSK-UHFFFAOYSA-N
ID: 100631
SMILES:C1(O)(C)CCC=C2Cc3c(O)cc(C)cc3OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.502
InChIKey:VBBAJFPMMMPIJF-UHFFFAOYSA-N
ID: 100632
SMILES:c1c(C)c(O)cc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N