ID: 104959
SMILES:C12C(C(=O)CC(C)C1)c1c(cc(CCCCC)c(O)c1O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.817
InChIKey:CDOAJUXZDKPVSB-UHFFFAOYSA-N
ID: 104960
SMILES:C(C(=O)OCC1(C)C2C1c1c(cc(CCCCC)cc1O)O2)Cc1ccccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -13.754
InChIKey:XTZOBNPJXPVKID-UHFFFAOYSA-N
ID: 104961
SMILES:C1(C)CCC2(O)C(CO)(C)Oc3cc(C)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -17.366
InChIKey:LYDWJNIGOXHGGR-UHFFFAOYSA-N
ID: 104962
SMILES:C1C(C(C)(O)C)OC2=C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -9.009
InChIKey:AVBOKLIDXNYSSO-UHFFFAOYSA-N
ID: 104963
SMILES:C(C1C(C(=C)CO)C(c2c(O)cc(CCCC)cc2O)CC1C)(O)CO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.31
InChIKey:FRXBOSZJXRXWSZ-UHFFFAOYSA-N
ID: 104964
SMILES:CC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 104965
SMILES:CC1(C)Oc2cc(CCC)cc(O)c2C2C1C1(C)CCCC(C)(C)C1C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.008
InChIKey:BFARZNVEKASDPM-UHFFFAOYSA-N
ID: 104966
SMILES:Oc1cc(CCCCC)cc2c1C1(C(C)(C)CCCC1C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.636
InChIKey:PJTPRZSKGDHQEH-UHFFFAOYSA-N
ID: 104967
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.055
InChIKey:IQTNAUYOSKQLEC-UHFFFAOYSA-N
ID: 104968
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 104969
SMILES:C1(=O)C(CO)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.778
InChIKey:UQPUAGROCZMHSP-UHFFFAOYSA-N
ID: 104970
SMILES:c1cc(CC(C)(O)CO)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -11.185
InChIKey:UXGHMXASDSFYOF-UHFFFAOYSA-N
ID: 104971
SMILES:C1=C(C)CC(O)C2C(C)(C)Oc3c(ccc(C)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.43
InChIKey:FESNAKVYURGNAE-UHFFFAOYSA-N
ID: 104972
SMILES:C(CCC(C)=C)OC1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -17.36
InChIKey:GIVDSZWZEXVPDL-UHFFFAOYSA-N
ID: 104973
SMILES:c1(O)c2c(c(OC)cc1CCCC)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.881
InChIKey:PRSHQYZZRCOIPG-UHFFFAOYSA-N
ID: 104974
SMILES:C(Cc1cc(O)c(C(=O)CC=C(C)C)c(OC2C(O)C(O)C(O)C(CO)O2)c1)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.544
CB1 binding score: -12.247
InChIKey:RHRVXOYKYCXBGQ-UHFFFAOYSA-N
ID: 104975
SMILES:Oc1cc(CCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 104976
SMILES:C1C(C(C)(C)O)C(c2c(O)cc(CCC)cc2O)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 104977
SMILES:COc1cc(CC=C(CC(=CC(C)(C)O)C)C)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.745
InChIKey:DCGOANMYCAVWIJ-UHFFFAOYSA-N
ID: 104978
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 104979
SMILES:COc1c2c(cc(C)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -20.378
InChIKey:FHEGDZWZIHISBE-UHFFFAOYSA-N