ID: 117706
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)C(CCC(C)(O)C=C)C(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.941
InChIKey:QAQFVDMDGLBWLD-UHFFFAOYSA-N
ID: 117707
SMILES:C(=C(C)C)C(C1C(C)(C)C=C(C)C1)c1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.67
CB1 binding score: -13.069
InChIKey:GBKITHCDHDTDQA-UHFFFAOYSA-N
ID: 117708
SMILES:C12CC(C(O)(C)C)C=CC1(C)Oc1c2c(O)cc(C(C)C(=C)CCC=C(C)CCC=C(C)C)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -12.695
InChIKey:IRGRGYLCHNPIGY-UHFFFAOYSA-N
ID: 117709
SMILES:COc1c(=O)c2c(oc1)C(CCC=C(C)C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -13.984
InChIKey:ZNWBZUVECNWHEH-UHFFFAOYSA-N
ID: 117710
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 117711
SMILES:c12c(cc(O)cc1CCCCC)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.291
InChIKey:FFUWPSOUQRLGHT-UHFFFAOYSA-N
ID: 117712
SMILES:c1(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 117713
SMILES:CC1=CCC(c2c(O)cc(CCCCC)cc2OC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.154
InChIKey:GUMIZAGPIPEHOJ-UHFFFAOYSA-N
ID: 117714
SMILES:c1(O)c2c(ccc1CCCCC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.926
InChIKey:PHOCHXXTKASADH-UHFFFAOYSA-N
ID: 117715
SMILES:CC1(C)Oc2cc(CCCCCC)cc(O)c2C2C1C(O)C=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.111
InChIKey:NNZKIQXQCYKKFL-UHFFFAOYSA-N
ID: 117716
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCC)cc2O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 117717
SMILES:C1(=O)c2c(CCCCC)cc(O)cc2C2CC(C)=CCC2C(C)(C)OO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.519
InChIKey:FWNBFSNZDVABLL-UHFFFAOYSA-N
ID: 117718
SMILES:C(CCCCCCCCCC)CCCCCCCCC(OC)c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.9
CB1 binding score: -6.963
InChIKey:RPNMIUDQPOEAKM-UHFFFAOYSA-N
ID: 117719
SMILES:C1(C(C)C)CCC(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 117720
SMILES:C(CCc1cc2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2)C(c1cc(O)c(C=O)cc1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -14.152
InChIKey:NEXJBHGFYYGSHV-UHFFFAOYSA-N
ID: 117721
SMILES:O(C1C(C(C)C)CCC(C)C1)Oc1cc(CCCCC)cc(Oc2ccc(C(C)(C)C)cc2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -14.116
InChIKey:MUEMKITXJXLWKT-UHFFFAOYSA-N
ID: 117722
SMILES:C1(O)=C(CC=C(C)C)C(=O)C(=C(O)c2cc(C)cc(O)c2C)Oc2c(CCCCC)cc(O)c(C3C(C(=C)C)CCC(C)=C3C)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 626.834
CB1 binding score: -18.091
InChIKey:PENODSJQUVUNGJ-UHFFFAOYSA-N
ID: 117723
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC(O)C(C)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.161
InChIKey:ACOOJIGWNLQARK-UHFFFAOYSA-N
ID: 117724
SMILES:C(CCc1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.779
InChIKey:VXMYRUJLTHSFQU-UHFFFAOYSA-N
ID: 117725
SMILES:C1CC(C)=CCCC(O)(C)C2C(C1)C(C)(C)Oc1cc(C(=O)OC)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.605
InChIKey:BQHLGCLZUKFPRQ-UHFFFAOYSA-N
ID: 117726
SMILES:c1c(O)c(CC=C(C)C)c(O)c(C2C=C(C)C(O)CC2C(C)=C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.95
InChIKey:HINBTQFONLFTAR-UHFFFAOYSA-N