ID: 86815
SMILES:c1c(O)c2c(cc1CCC)OC(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: 86816
SMILES:C1(=O)C2(O)C(C)(C)CCCC2(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -15.658
InChIKey:XKUKEYNXNSRSQV-UHFFFAOYSA-N
ID: 86817
SMILES:CC(C)=CCC1=C2OC(C)(C)C3C2C(CC(C)=CC3)C(C=CO)C(=O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.485
InChIKey:KPENFUNLAYOBAZ-UHFFFAOYSA-N
ID: 86818
SMILES:C(Cc1c(CCCCC)cc2c(c1O)C1CC(=CCC=C(C)C)C(=O)OC1(C)C2)=C(C)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -13.1
InChIKey:OBVNBULGWACZFO-UHFFFAOYSA-N
ID: 86819
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(=O)C1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 86820
SMILES:C(OC1C(O)C(O)C(O)C(CO)O1)C1=CC2C(CC1)C(C)(C)Oc1cc(C)c(OC)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.528
CB1 binding score: -12.784
InChIKey:CTSJQYRURCOWFP-UHFFFAOYSA-N
ID: 86821
SMILES:C12(C)CCC(C(C)C)C1c1c(cc(CCCCC)c(C(=O)O)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.482
InChIKey:ZZGHZXLGNOBGGV-UHFFFAOYSA-N
ID: 86822
SMILES:CC(C)c1ccc2c(c1)OC(CCC=C(CCC=C(C)C)C)(C)CC2c1ccc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.784
CB1 binding score: -15.519
InChIKey:NBNMZXUXMYUCFS-UHFFFAOYSA-N
ID: 86823
SMILES:C1(c2oc(C)c(C)c2)C(C(C)=C)C(c2c(OC)ccc(CCCCC)c2)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -12.676
InChIKey:ROIMYWQWPJZRNJ-UHFFFAOYSA-N
ID: 86824
SMILES:C1(C(C)=C)CCC(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.57
InChIKey:LURPWARMGYBTPS-UHFFFAOYSA-N
ID: 86825
SMILES:C(C)(=CCCC1(C)Oc2cc(CCCCC)c(C(=O)O)cc2C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.718
InChIKey:BEMDFPISFCAMPJ-UHFFFAOYSA-N
ID: 86826
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.346
InChIKey:UOSUIHXLUAJQTP-UHFFFAOYSA-N
ID: 86827
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -19.22
InChIKey:AHKIGVNVQSVNEP-UHFFFAOYSA-N
ID: 86828
SMILES:C1(=O)C(O)=C(C(C)C)C2C3C(C)(CCCC12C)Oc1c(c(O)cc(CCCCC)c1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.885
InChIKey:CZYHBIGMEFTRKJ-UHFFFAOYSA-N
ID: 86829
SMILES:C(CCCCC(Cc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.244
InChIKey:UZPFHIYOENOLDM-UHFFFAOYSA-N
ID: 86830
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.404
InChIKey:IBSBWOIOMTZHJY-UHFFFAOYSA-N
ID: 86831
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 86832
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 86833
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)=C)CCC(C)(O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 86834
SMILES:CC(C)=CCC1C(C)(C)Oc2cc(C)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 246.35
CB1 binding score: -17.652
InChIKey:FRZIZPCHLXOTOT-UHFFFAOYSA-N
ID: 86835
SMILES:CC(C1C2c3c(O)cc(CCC)cc3OC(C)(C)C2CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.313
InChIKey:MLJWWUZZQJVDEG-UHFFFAOYSA-N