ID: 38011
SMILES:C(C)(C1C(c2c(O)cc(CCCCCO)cc2O)C=C(C=O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.808
InChIKey:ZNOKLPVRMLHRNP-UHFFFAOYSA-N
ID: 38012
SMILES:CC(C)C(=O)C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.271
InChIKey:VQVLBQJJHOOZPE-UHFFFAOYSA-N
ID: 38013
SMILES:c1c(C2C(CC(C)=CC=O)OC2(C)C)c(O)c(C3C=C(C)CCC3C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.055
InChIKey:MLQGGOGHLXHQOQ-UHFFFAOYSA-N
ID: 38014
SMILES:CC1C2(C)C(CCC1)C(C(O)CC(=CCc1c(O)c(C)cc(OC)c1)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -17.138
InChIKey:YFJBFNXKHSORFE-UHFFFAOYSA-N
ID: 38015
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 38016
SMILES:c1(O)cc(CCCC)cc2c1OC(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.131
InChIKey:JSFVSOFLFYHGTE-UHFFFAOYSA-N
ID: 38017
SMILES:CC(OCC1=Cc2c(cc(CCCCC)cc2O)OC1(CCC=C(C)C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.552
InChIKey:QNXAXLKDGNGBJT-UHFFFAOYSA-N
ID: 38018
SMILES:c1(CCCC)cc2c(cc1O)OC(C)(C)C1CC=C(C)C(O)C21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.025
InChIKey:YERUAOSNTGSLAI-UHFFFAOYSA-N
ID: 38019
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 38020
SMILES:C(CC(C)=C1CC(C)(C)C(=O)C1O)CC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.648
InChIKey:OHXBUYVMBLFYTA-UHFFFAOYSA-N
ID: 38021
SMILES:COc1cc(C)cc2c1-c1c(cc(CCCCC)cc1O)OC(C)(C)C1C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.29
InChIKey:HHTSXYAMOLJYSB-UHFFFAOYSA-N
ID: 38022
SMILES:C1(O)C(C)C2C(=C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.974
InChIKey:CHGDTXOWVPBOOP-UHFFFAOYSA-N
ID: 38023
SMILES:C(=C(C(c1c(CCCCC)cc2c(c1O)CC1CC(=C)CCC1C(C)(C)O2)CCC)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.696
CB1 binding score: -14.321
InChIKey:NKYCCCKSSWQXEV-UHFFFAOYSA-N
ID: 38024
SMILES:CC(C)=CCC1OC1(C)C1C(c2c(O)cc(CC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.152
InChIKey:ZWEOUCRBCOIGFS-UHFFFAOYSA-N
ID: 38025
SMILES:CC(C1Oc2cc(CC=C(C)CCC=C(C)C)c(O)cc2C1)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.43
InChIKey:SCABXBQQYONFIE-UHFFFAOYSA-N
ID: 38026
SMILES:C(CCC)CCc1cc(O)c(CC=C(C)COC=O)c(OC)c1C=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -12.904
InChIKey:GNBKMAQJZMEJKO-UHFFFAOYSA-N
ID: 38027
SMILES:C(CCCc1cc(OC)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -16.228
InChIKey:ZGFIWPJNNSPZSN-UHFFFAOYSA-N
ID: 38028
SMILES:C12(O)C(C)(CCCC1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.209
InChIKey:USPUUPOIYPKNOZ-UHFFFAOYSA-N
ID: 38029
SMILES:C1(c2c(O)ccc3c(=O)c(C(CCC)=O)c4c(cc23)OC(C)(C)C2C4C=C(C)CC2)OC(C)(C)C2CCC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.705
CB1 binding score: -15.379
InChIKey:FYRZJXQTEXNMQV-UHFFFAOYSA-N
ID: 38030
SMILES:O=C(C(CCc1c2c(cc(C)c1)OC(C)(C)C1C2CC(C)CC1)C)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -12.019
InChIKey:GXJZRYGAMPGBHQ-UHFFFAOYSA-N
ID: 38031
SMILES:COc1c(C(C(C)C)C(OC(C)=O)C)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.959
InChIKey:NLRZILKVBABYEY-UHFFFAOYSA-N