ID: 71989
SMILES:O=C(OC)Cc1cc2c(c(O)c1)C1C(CC(C)(C)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.304
CB1 binding score: -14.026
InChIKey:HOOUEGRVJWSYGD-UHFFFAOYSA-N
ID: 71990
SMILES:c12c3cc(C)c(C(C)C(C)C)c3OC(C)(C)OC1CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.069
InChIKey:RXTVFMPHPVPHTI-UHFFFAOYSA-N
ID: 71991
SMILES:c1(C(C2CC(O)C(C)(C)O2)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.445
CB1 binding score: -11.984
InChIKey:OCEVUFAOHLPARC-UHFFFAOYSA-N
ID: 71992
SMILES:c1(O)c(C(=O)CC(C)C)c2c(c(O)c1CC(C)C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.294
InChIKey:LIMMXADUNUZLBM-UHFFFAOYSA-N
ID: 71993
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.967
InChIKey:WOYOXVOVSDOOHO-UHFFFAOYSA-N
ID: 71994
SMILES:OC(C)(C)C=CCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.639
InChIKey:YPQWGXMNDAZBBL-UHFFFAOYSA-N
ID: 71995
SMILES:C1(C(C)C)C2c3c(cc(CCCCC)cc3O2)OC(CC=C(C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.051
InChIKey:APGLRZMYXNIJLN-UHFFFAOYSA-N
ID: 71996
SMILES:c1(CCCCC)cc(O)c2c(c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.611
InChIKey:QXUCLIISXIFDCN-UHFFFAOYSA-N
ID: 71997
SMILES:c1c2c(cc(CCCC)c1O)C(=O)C1=C(C2=O)OC(C)(C)C2CCC(C)=CC12
Pathway: Polyketides
Superclass: Naphthalenes;Meroterpenoids
Class: Cannabinoids;Naphthoquinones
MW: 380.484
CB1 binding score: -15.169
InChIKey:NLEJGCRETFYLJZ-UHFFFAOYSA-N
ID: 71998
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 71999
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(CCC=C(C)C)(C)O)C(C(=O)CC(OC)C)OC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.638
CB1 binding score: -16.166
InChIKey:SWFLUCCTGYMFLA-UHFFFAOYSA-N
ID: 72000
SMILES:c1c2c(cc(C)c1)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.155
InChIKey:MXSWDTMEPHWSDH-UHFFFAOYSA-N
ID: 72001
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)C1C2C(OC(=O)C)C(C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.972
InChIKey:VXOXTMYTPYRQKN-UHFFFAOYSA-N
ID: 72002
SMILES:C1(C)(C)Oc2cc(CCCCC)c(O)c(O)c2C2CC(C)=CC(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.502
InChIKey:RDXQCSXMMYWDSP-UHFFFAOYSA-N
ID: 72003
SMILES:C(CCC)Cc1cc(O)cc(OC2C(C(C)C)CCC(C)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.485
InChIKey:HPDQBMCWIWSUFJ-UHFFFAOYSA-N
ID: 72004
SMILES:c1(O)c2c(cc(C(C)COC(=O)C)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.322
InChIKey:RKOLGYJEMHPARA-UHFFFAOYSA-N
ID: 72005
SMILES:c1(O)cc(CCCCC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.133
InChIKey:NWNXONBQZMRACD-UHFFFAOYSA-N
ID: 72006
SMILES:C12C(C=CC(=O)C1(C)C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.675
InChIKey:FQNCAWUFQGAGDX-UHFFFAOYSA-N
ID: 72007
SMILES:c1c(O)cc(C)c2c1-c1c(cc(O)cc1CCC(C)C1=CC3(C)Oc4c(C)cc(OC)cc4C3(C)CC1)CC(C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.782
CB1 binding score: -16.987
InChIKey:PIVRWKUQUMRNCY-UHFFFAOYSA-N
ID: 72008
SMILES:C1CC(O)=C(C)C2=CC(O)C3(C=O)C(C)CC(c4c(OC)cccc4)C(C)=C3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -12.73
InChIKey:UWHINMQLMFAIPD-UHFFFAOYSA-N
ID: 72009
SMILES:CC1(C)C2CCC(C)=CC2c2c(OC)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.951
InChIKey:WXBVFVGGEVVYPO-UHFFFAOYSA-N