ID: 114829
SMILES:O=C(Oc1c2c(ccc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c1-2)CCc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.598
CB1 binding score: -16.83
InChIKey:IEMGNGMPGMJCCH-UHFFFAOYSA-N
ID: 114830
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 114831
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 114832
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C(O)OC)CC(=O)C(C(CC(O)C=C(C)C)=C)C2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.632
CB1 binding score: -13.255
InChIKey:YKLQQOUIKXXAHS-UHFFFAOYSA-N
ID: 114833
SMILES:O(CCC)c1c(C2C(C(C)=C)CCC(C)=C2)c(O)c(OC)c(CC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.425
InChIKey:OZQAXGAEUOWPHM-UHFFFAOYSA-N
ID: 114834
SMILES:O1CC2C(=C)CCC=C(C)CCC2C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.527
InChIKey:PXNHYWRNUSTVMK-UHFFFAOYSA-N
ID: 114835
SMILES:C(C(=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C)C)=CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.427
InChIKey:OGICNLBIZSFWLP-UHFFFAOYSA-N
ID: 114836
SMILES:C(C)(C1=CCC(C)(C)Oc2cc(CCCCC)cc(O)c21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.569
InChIKey:MTWOCWFQABBQJR-UHFFFAOYSA-N
ID: 114837
SMILES:O(c1cc(C(COC(=O)C)OC(C)=O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -15.395
InChIKey:NUSAJLSSBBPGSV-UHFFFAOYSA-N
ID: 114838
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)cc(=O)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -16.515
InChIKey:FQGXDOUSNIYZSM-UHFFFAOYSA-N
ID: 114839
SMILES:C(C=C(C)C)CC(=CCc1c(O)cc(CCC)cc1O)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.998
InChIKey:YXQZQYZQJAXTEM-UHFFFAOYSA-N
ID: 114840
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(CCC(C)O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.253
InChIKey:HZSMMHJMRGNVEQ-UHFFFAOYSA-N
ID: 114841
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -17.329
InChIKey:UXMYALNHHLVVAU-UHFFFAOYSA-N
ID: 114842
SMILES:C1CCC2(C)C3(C(=O)c4c(O)cc(CCCCC)cc4OC3C(C(O)(C)C)O2)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.605
InChIKey:FWHZWWVATHTBKC-UHFFFAOYSA-N
ID: 114843
SMILES:CCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.265
InChIKey:KTPDAZGMXXWSMU-UHFFFAOYSA-N
ID: 114844
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2C1(C)C=CC(=O)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -12.913
InChIKey:GMATUYFDFDEPER-UHFFFAOYSA-N
ID: 114845
SMILES:C1C(C)=CC2c3c(cc(CCCCC)cc3OC2=O)OCC(CO)=CC2C(C1=O)C(C)CC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -13.82
InChIKey:CSUVEVBCOBLTOW-UHFFFAOYSA-N
ID: 114846
SMILES:c1c(CCCCC)cc2c(c1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.438
CB1 binding score: -16.502
InChIKey:QWCMGHBKJWEFFY-UHFFFAOYSA-N
ID: 114847
SMILES:CC(C)C1CCC(C)CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 114848
SMILES:C1=C(C)C(O)C(c2c(O)cc(CCCCC)cc2O)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.46
InChIKey:IYBWFUKJQOSJJS-UHFFFAOYSA-N
ID: 114849
SMILES:C1(C)(C)C2CC(O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N