ID: 114115
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)c(C=O)c(O)c2c1C(CCC=C(C)C)C(=O)OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -9.844
InChIKey:AGXXXYNWYNRJQT-UHFFFAOYSA-N
ID: 114116
SMILES:c1(OC)cc(O)c(C)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.67
InChIKey:JEEKBPFZVIOBDI-UHFFFAOYSA-N
ID: 114117
SMILES:C(OC(C)(C)C1CCC(C)=CC1=O)(c1c(OC)cc(CCCCC)cc1OC(C)=O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -11.976
InChIKey:PZFRRPUFNKOFJL-UHFFFAOYSA-N
ID: 114118
SMILES:Oc1c(C2C(C(C)=C)C(c3c(CC=C)cc(O)c(C)c3)C=C(C)CC2)c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.685
CB1 binding score: Not available
InChIKey:VUAZGTAMDGHRGN-UHFFFAOYSA-N
ID: 114119
SMILES:C(CC=C(CCC=C(C)C)C)C1(C)Oc2cc(CCc3ccc(O)cc3)cc(O)c2CC1OC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.656
CB1 binding score: -16.393
InChIKey:AFRKKWROKBTRKU-UHFFFAOYSA-N
ID: 114120
SMILES:C1C(O)C2C(C)(C)Oc3ccc(CCCCC)cc3C2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -12.125
InChIKey:ZHIDSPCRSWXUQP-UHFFFAOYSA-N
ID: 114121
SMILES:C1(C)(C)C2CC(O)C(C)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.944
InChIKey:BNHIPIUQMWYYNY-UHFFFAOYSA-N
ID: 114122
SMILES:C(CCc1cc2c(c(O)c1)C1C(O)C(C)(O)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 114123
SMILES:COc1c(CCCCC)cc2c(c1O)-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -18.616
InChIKey:PYKBXNRGFBKQTI-UHFFFAOYSA-N
ID: 114124
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1c2ccc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.589
InChIKey:ILPMEUDSBVWXIW-UHFFFAOYSA-N
ID: 114125
SMILES:C1(C)(C)OC1CCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.684
InChIKey:ORFOMKNCAVCUFO-UHFFFAOYSA-N
ID: 114126
SMILES:CC1=CC2c3c(O)cc(CCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 114127
SMILES:C(c1cc(O)c(C2C=C(C)CC(O)C2C(C)=C)c(O)c1)CC(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.422
InChIKey:HOVFRVSNLJSMQK-UHFFFAOYSA-N
ID: 114128
SMILES:C1C(C)(C)C2CCC(C)C1(Oc1cc(CCCCC)cc(O)c1)C=CC=CC(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.566
InChIKey:KCFHKHXTXBXXLO-UHFFFAOYSA-N
ID: 114129
SMILES:CC(OC(C)=O)(C1Oc2cc(C)cc(OC)c2C=CC(CCC=C(C)C)(O)C1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -15.239
InChIKey:LVWNFPIYNPUPOE-UHFFFAOYSA-N
ID: 114130
SMILES:CC1(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 114131
SMILES:C1c2c(O)c(=O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.507
InChIKey:ZOTBHFPELLVSAC-UHFFFAOYSA-N
ID: 114132
SMILES:CC(C1CCC(C=O)=CC1c1c(O)cc(CCCCC)cc1OC(C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.567
InChIKey:IYOMJTCJYLCUSV-UHFFFAOYSA-N
ID: 114133
SMILES:C1(C)(C)C=CCC2(C)Oc3c(c(OC(C)=O)c(OC(=O)C)cc3CCCCC)CC2C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -15.706
InChIKey:JXRMVRUVTSQBLC-UHFFFAOYSA-N
ID: 114134
SMILES:C(Cc1cc(N)cc(C2CCCC2(CCC2OC2(C)C)CO)c1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.527
CB1 binding score: -13.015
InChIKey:GPEOUHKBAMEGJX-UHFFFAOYSA-N
ID: 114135
SMILES:C12C(C)C(O)CC3C1(C)Oc1cc(CCCCCC)cc(O)c1C3C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.879
InChIKey:GASVVXHULOSTFE-UHFFFAOYSA-N